afrl-rx-wp-ja-2017-0365afrl-rx-wp-ja-2017-0365 . making the case for a model-based definition of...

18
AFRL-RX-WP-JA-2017-0365 MAKING THE CASE FOR A MODEL-BASED DEFINITION OF ENGINEERING MATERIALS (POSTPRINT) David U. Furrer Pratt & Whitney Dennis M. Dimiduk BlueQuartz James D. Cotton Boeing Charles Ward AFRL/RX 24 May 2017 Interim Report Distribution Statement A. Approved for public release: distribution unlimited. © 2017 SPRINGER (STINFO COPY) AIR FORCE RESEARCH LABORATORY MATERIALS AND MANUFACTURING DIRECTORATE WRIGHT-PATTERSON AIR FORCE BASE, OH 45433-7750 AIR FORCE MATERIEL COMMAND UNITED STATES AIR FORCE

Upload: others

Post on 22-Oct-2020

3 views

Category:

Documents


0 download

TRANSCRIPT

  • AFRL-RX-WP-JA-2017-0365

    MAKING THE CASE FOR A MODEL-BASED DEFINITION OF ENGINEERING MATERIALS (POSTPRINT) David U. Furrer Pratt & Whitney Dennis M. Dimiduk BlueQuartz James D. Cotton Boeing Charles Ward AFRL/RX

    24 May 2017 Interim Report

    Distribution Statement A.

    Approved for public release: distribution unlimited.

    © 2017 SPRINGER

    (STINFO COPY)

    AIR FORCE RESEARCH LABORATORY MATERIALS AND MANUFACTURING DIRECTORATE

    WRIGHT-PATTERSON AIR FORCE BASE, OH 45433-7750 AIR FORCE MATERIEL COMMAND

    UNITED STATES AIR FORCE

  • REPORT DOCUMENTATION PAGE Form Approved OMB No. 0704-0188 The public reporting burden for this collection of information is estimated to average 1 hour per response, including the time for reviewing instructions, searching existing data sources, gathering and maintaining the data needed, and completing and reviewing the collection of information. Send comments regarding this burden estimate or any other aspect of this collection of information, including suggestions for reducing this burden, to Department of Defense, Washington Headquarters Services, Directorate for Information Operations and Reports (0704-0188), 1215 Jefferson Davis Highway, Suite 1204, Arlington, VA 22202-4302. Respondents should be aware that notwithstanding any other provision of law, no person shall be subject to any penalty for failing to comply with a collection of information if it does not display a currently valid OMB control number. PLEASE DO NOT RETURN YOUR FORM TO THE ABOVE ADDRESS.

    1. REPORT DATE (DD-MM-YY) 2. REPORT TYPE 3. DATES COVERED (From - To)24 May 2017 Interim 17 September 2015 – 24 April 2017

    4. TITLE AND SUBTITLEMAKING THE CASE FOR A MODEL-BASED DEFINITION OFENGINEERING MATERIALS (POSTPRINT)

    5a. CONTRACT NUMBER FA8650-15-D-5800-0018

    5b. GRANT NUMBER

    5c. PROGRAM ELEMENT NUMBER 62102F

    6. AUTHOR(S)1) David U. Furrer –

    Pratt & Whitney2) Dennis M. Dimiduk –

    BlueQuartz

    (Continued on page 2)

    5d. PROJECT NUMBER 4347

    5e. TASK NUMBER 5f. WORK UNIT NUMBER

    X15P 7. PERFORMING ORGANIZATION NAME(S) AND ADDRESS(ES) 8. PERFORMING ORGANIZATION REPORT NUMBER

    1) Pratt and Whitney400 Main St, EastHartford, CT 06118

    2) BlueQuartz Software400 S Pioneer Blvd,Springboro, OH 45066

    (Continued on page 2) 9. SPONSORING/MONITORING AGENCY NAME(S) AND ADDRESS(ES) 10. SPONSORING/MONITORING AGENCY

    Air Force Research LaboratoryMaterials and Manufacturing Directorate Wright-Patterson Air Force Base, OH 45433-7750 Air Force Materiel Command United States Air Force

    ACRONYM(S)

    AFRL/RXM11. SPONSORING/MONITORING AGENCY

    REPORT NUMBER(S)AFRL-RX-WP-JA-2017-0365

    12. DISTRIBUTION/AVAILABILITY STATEMENTDistribution Statement A. Approved for public release: distribution unlimited.

    13. SUPPLEMENTARY NOTESPA Case Number: 88ABW-2017-2576; Clearance Date: 24 May 2017. This document contains color. Journal article publishedin Integrating Materials and Manufacturing Innovation. © 2017 Springer. The U.S. Government is joint author of the workand has the right to use, modify, reproduce, release, perform, display, or disclose the work.The final publication is available at http://scitech.aiaa.org/

    14. ABSTRACT (Maximum 200 words)For over 100 years, designers of aerospace components have used simple requirement-based material and process specifications.The associated standards, product control documents, and testing data provided a certifiable material definition, so as to minimizerisk and simplify procurement of materials during the design, manufacture, and operation of engineered systems, such as aerospaceplatforms. These material definition tools have been assembled to ensure components meet design definitions and design intent.They must ensure the material used meets “equivalency” to that used in the design process. Although remarkably effective, suchtraditional materials definitions are increasingly becoming the limiting challenge for materials, design, and manufacturing engineerssupporting modern, model-based engineering. Demands for cost-effective, higher performance aerospace systems are driving newapproaches for multi-disciplinary design optimization methods that are not easily supportable via traditional representations ofmaterials information.15. SUBJECT TERMS

    ICME; MGI; Model-based engineering; Model-based definition; Model-based material definition; Digital engineering;Materials specifications; Representative volume elements; SERVEs

    16. SECURITY CLASSIFICATION OF: 17. LIMITATIONOF ABSTRACT:

    SAR

    18. NUMBEROF PAGES

    18

    19a. NAME OF RESPONSIBLE PERSON (Monitor) a. REPORTUnclassified

    b. ABSTRACTUnclassified

    c. THIS PAGEUnclassified

    Charles Ward 19b. TELEPHONE NUMBER (Include Area Code)

    (937) 255-2738Standard Form 298 (Rev. 8-98) Prescribed by ANSI Std. Z39-18

  • REPORT DOCUMENTATION PAGE Cont’d 6. AUTHOR(S)

    3) James D. Cotton - Boeing 4) Charles H. Ward - AFRL/RX

    7. PERFORMING ORGANIZATION NAME(S) AND ADDRESS(ES)

    3) The Boeing Co. 1420 S Trenton St # 1505 Seattle, WA 98108

    4) AFRL/RX Wright-Patterson AFB, Dayton, OH 45433

    Standard Form 298 (Rev. 8-98) Prescribed by ANSI Std. Z39-18

  • Integr Mater Manuf Innov (2017) 6:249–263DOI 10.1007/s40192-017-0102-7

    REVIEW ARTICLE

    Making the Case for a Model-Based Definitionof Engineering Materials

    David U. Furrer1 ·Dennis M. Dimiduk2 · James D. Cotton3 ·Charles H. Ward4

    Received: 2 June 2017 / Accepted: 18 August 2017 / Published online: 12 September 2017© The Author(s) 2017. This article is an open access publication

    Abstract For over 100 years, designers of aerospace com-ponents have used simple requirement-based material andprocess specifications. The associated standards, productcontrol documents, and testing data provided a certifiablematerial definition, so as to minimize risk and simplifyprocurement of materials during the design, manufacture,and operation of engineered systems, such as aerospaceplatforms. These material definition tools have been assem-bled to ensure components meet design definitions anddesign intent. They must ensure the material used meets“equivalency” to that used in the design process. Althoughremarkably effective, such traditional materials definitionsare increasingly becoming the limiting challenge for mate-rials, design, and manufacturing engineers supporting mod-ern, model-based engineering. Demands for cost-effective,higher performance aerospace systems are driving new

    � David U. [email protected]

    Dennis M. [email protected]

    James D. [email protected]

    Charles H. [email protected]

    1 Pratt and Whitney, East Hartford, CT, USA

    2 BlueQuartz Software, Dayton, OH, USA

    3 The Boeing Co., Seattle, WA, USA

    4 Air Force Research Laboratory, Wright-Patterson AFB,OH, USA

    approaches for multi-disciplinary design optimization meth-ods that are not easily supportable via traditional representa-tions of materials information. Furthermore, property designvalues having the definitions based on statistical distribu-tions from testing results can leave substantial margin ormaterial capability underutilized, depending on componentcomplexity and the application. Those historical statisticalapproaches based on macroscopic testing inhibit innovativeapproaches for enhancing materials definitions for greaterperformance in design. This can include location-specificproperties, hybrid materials, and additively manufacturedcomponents. Development and adoption of digital andmodel-based means of representing engineering materials,within a design environment, is essential to span the widen-ing gap between materials engineering and design. Webelieve that the traditional approach to defining materials bychemistry ranges, manufacturing process ranges, and staticmechanical property minima will migrate to model-basedmaterial definitions (MBMDs), due to the many benefitsthat result from this new capability. This paper reviewsaspects of the challenges and opportunities of model-basedengineering and model-based definitions.

    Keywords ICME · MGI · Model-based engineering ·Model-based definition · Model-based material definition ·Digital engineering · Materials specifications ·Representative volume elements · SERVEs

    Introduction

    For over a century, the procurement of general industrialand aerospace products has relied on materials and pro-cess specifications. Specifications typically set a minimumlevel of requirements based on pragmatic chemistry control

    1 Distribution A. Approved for public release (PA): distribution unlimited.

    http://crossmark.crossref.org/dialog/?doi=10.1007/s40192-017-0102-7&domain=pdfhttp://orcid.org/0000-0002-5813-439Xmailto:[email protected]:[email protected]:[email protected]:[email protected]

  • 250 Integr Mater Manuf Innov (2017) 6:249–263

    and/or mechanical properties, with minimal or subjectivemicrostructural controls. These standards, product controldocuments, and testing data largely comprise procurementdocuments that ensure components produced from specifiedmaterials meet minimum design intent. Component produc-tion is enabled by design methods (with minimum propertyrepresentation), quality inspection standards, and compo-nent testing and qualification procedures, yet all dependon these basic documents aimed at minimizing program-matic and operational risks by “locking down” materialsand processes–and therefore specific component materialbehavior and variation. Very often this approach is sufficientgiven the specific combination of design, material, process,and application. However, a consequence of this approachare tables of conservative design values that are static rep-resentations of a material’s worst-of-the-worst capabilityvia statistical analysis within limited application of specificrequirements for particular gauge ranges. Further, staticmaterial property minimum representations only apply forthe process ranges that are physically produced and testedand cannot be extrapolated to account for process vari-ations or changes. It is somewhat ironic that while it iswell-established that composition and process produce aspecific range of microstructures, and such microstructurescontrol mechanical properties, microstructure is often notmonitored nor controlled. Thus, the lack of microstructurefocus forces the design community to a traditional approachof collapsing natural property variations into a single min-imum value. While practical, this simplification inhibitsapplication of a material’s full capability and can lead toconsiderable suboptimization in the design process. It canalso inherently limit component design to material condi-tions for which extensive test data have been generated.This contrasts sharply with other aspects of engineering forwhich digital methods are widely applicable at the designstage.

    Unlike structural materials and processes engineering,nearly all other engineering design has converted to digi-tal methods and model-based optimization. Physics-basedmethods, such as finite element analysis of structures andcomputational fluid dynamics, have enabled other engi-neering disciplines to adopt practices based upon digitalrepresentations. These are often referred to as Model-Based Engineering (MBE). Current MBE of componentsuses advanced optimization methods to ensure the finalcomponent and system efficiently meets customer require-ments. Parametric models are used to seek optimal con-figurations based on the range of objective functions forthe parametric search and the features included in theparametric analysis. MBE uses models on an application-specific basis as an integral part of the engineering technicalbaseline that includes the requirements, analysis, design,

    implementation, and verification of a capability, system,and/or product throughout the product life cycle [1]. Unlikematerials and processes engineering, MBE relies on digi-tal representations, or a model-based definition (MBD), todefine a product throughout design, manufacturing and sus-tainment. Analogously, model-based materials definitions(MBMD) are needed to provide parametric materials-basedoptimization capabilities to engineering for better achievingcustomer needs. However, the application of MBE in thematerials domain will be initially limited to components thatdue to their criticality, complexity, or cost justify the addedexpense this incurs.

    In recognition of this shift, the US Department of Defen-se issued MIL-STD-31000A in 2013 to incorporate digitally-based, 3D Computer Aided Design (CAD) models of com-ponents [2]. However, even this revised standard, whichsupports post-production component procurement (sparesand replacement parts), still relies on traditional representa-tion of materials information through material compositionand associated process specifications. Unfortunately, todaythis type of analysis is performed while having materialproperties being represented as constants that are set atthe same minimum values across the entire bounds (spatialrange) of a component. Refined optimization of componentsneeds to include the ability to design, specify, and certifythe material requirements locally within a high-performancepart (i.e., location-specific designing) through which theentire capability of a material can be enabled and utilized.

    In response, the nascent field of Integrated Computa-tional Materials Engineering (ICME) and the MaterialsGenome Initiative (MGI) are moving the materials andmanufacturing communities toward model-based materialsrepresentations [3, 4]. However, materials engineering todate has lacked the quantitative rigor, concerted community-wide actions, and practical methods of digital representationin an MBE environment. Other challenges include how toensure design certifications are maintained and how supplierquality systems can adapt as digital approaches emerge.These elements cannot be lost in the endeavor to buildmaterials standards upon digital MBMDs and are essentialto speeding the development and deployment of materialswhile managing risk to system design, manufacture, andsustainment.

    Material properties are functions of chemistry andhierarchical microstructures stemming from processing.Microstructural features (e.g., grain size, precipitate mor-phology, crystallographic texture, etc.) are path-dependentstate variables that depend upon initial state and subse-quent processing procedures. As such, the best metrics formaterial quality should be tied to chemistry and microstruc-ture measurements. However, it is impractical to con-duct detailed microstructural evaluations for the frequently

    2 Distribution A. Approved for public release (PA): distribution unlimited.

  • Integr Mater Manuf Innov (2017) 6:249–263 251

    occurring need of material lot-release testing. Addition-ally, not all aspects of the microstructural state are read-ily amenable to industrial production quantification, norare there established practices to manage spatially varyinghierarchical microstructural information within engineer-ing design systems. Current practices typically only samplechemistry and control process, collect easy to evaluatemechanical properties (e.g. tensile strength, hardness), andeither forgo or use limited microstructure metrics. Saiddifferently, the current practice is largely a composition-process-properties paradigm. Although commonplace, thislimiting paradigm adds cost, time and risk to the prod-uct development value stream since production of full-scaleparts is needed to establish capabilities. Further, the presentparadigm does not result in either a spatially resolved ormodel-based digital representation of the full material capa-bility that could enhance design practices and be more easilytransported in other component design efforts.

    In contrast, material performance requirements haveincreased in recent years as aerospace customers and cer-tification agencies demand more reliability, durability andsafety. This has resulted in burdensome supplier qualifica-tion exercises and complicated document management sys-tems. Consequently, it is time to consider a paradigm shiftfor representing materials knowledge as a series of mod-els (physics-based) that integrate material chemistry andprocess-path dependence to represent local microstructure,properties, and performance. Materials and process engi-neers need to devise a digital and model-based composition-process-structure-properties paradigm (i.e., model-basedmaterials definition or MBMD) to offer efficiency and flexi-bility to design engineering and to fully exploit conventionalmaterials and processes, and enable proactive and practicaluse of digital processes, such as additive manufacturing.

    The Traditional Process for RepresentingMaterials Information in Design and Manufacture

    To better understand the essence and needs for an MBDmaterials and processes engineering paradigm, here weexamine the current paradigm in more detail. Traditional

    document-based modes of sharing materials informationhave served both the scientific and engineering communi-ties extraordinarily well. As a consequence, current modesof information generation and flow within materials sci-ence and engineering from discovery through development,scale-up, product design and qualification, manufacture andsustainment have changed little over the past decades. Thisprocess is depicted in Fig. 1 and highlights the well-definedboundaries between the stages in a material’s lifecycle.

    The discovery stage of material development is largelythrough evolutionary changes to materials that are alreadyknown or through basic research, where new materialssystems are being explored. These efforts are driven exten-sively by Edisonian trial-and-error approaches that are timeconsuming and costly. It is common to use simulation andpredictive science tools in the materials discovery stage, butthese are far from being trusted at a production scale, wheremost of the cost is incurred. Thus, once a new material hasbeen investigated to a level where potential advantageousproperty values are observed, this material will be moved tothe next stage of preliminary property development for engi-neering purposes. Typically, a series of sub-scale samplesare produced and physically tested to enable a larger quan-tity of property tests to be conducted to study variabilityand feasibility for specific end use. These activities are con-ducted during the discovery and development stages shownin Fig. 1.

    When a production application is identified and an ade-quate business case exists, a specific component or familyof components are usually selected for application. Notethat assessing the business case for implementing a givenadvancement may require considerable time, and that mayitself evolve over time. Scale-up and production methods fora new material are usually based on knowledge of similarmaterials, which sets chemistry and process parameter tar-gets and tolerance controls. Large numbers of mechanicalproperty tests, usually in the 100’s or 1000’s of coupons, arethen carried out on production-representative componentconfigurations. Figure 2 shows a schematic example of afull-scale component where mechanical properties are mea-sured throughout the part volume [5]. The color contoursand the associated color-coded property distributions depict

    Fig. 1 Current flow of materialsand manufacturing informationin the material lifecycle

    3 Distribution A. Approved for public release (PA): distribution unlimited.

  • 252 Integr Mater Manuf Innov (2017) 6:249–263

    Fig. 2 Simulation of a forging showing the gradient of mechanicalproperties and the associated property distributions within specificlocations. Traditional material definitions would assume all locationsshould have the same property, so all test values would be combinedand statistically analyzed as one population, resulting in a very lowminimum property capability. Analyzing material properties withinindividual zones result in greatly increased local-specific minimumproperties

    how material properties inherently vary due to componentprocessing.

    If a new or modified material and/or process have beendetermined to be adequate to meet product requirements,either prior supplier experience, supplier control capabili-ties, or a rigorous statistical process are used to empiricallydefine the boundaries of chemistry and processing condi-tions in order to minimize material variability for design.Specifications may be issued from that information, eitherpublicly as in the case of Aerospace Materials Specifica-tions (AMS) published by the Society of Automotive Engi-neers (SAE), such as AMS4928 or AMS4911 for wroughtTi-6w/oAl-4w/oV (Ti-6-4) forged and rolled plate material,or they may be internal to companies and organizations asproprietary specifications. This provides a Quality System-based aspect to current material definitions. The specifica-tion typically contains allowable chemistry ranges, processmethod, microstructure descriptors (selectively), inspectionindication limits, and static surrogate property minima forlimited property types that represent the entire range ofstatic and dynamic property design capabilities. It is impor-tant to note that the specification does not typically providethe detailed process parameters such as temperature, strain,strain rate, number of passes, recrystallization schedule, etc.Rather, the suppliers have some latitude to operate withintheir equipment capabilities and the broad aspects of thespecification.

    Most specification and design allowable documentsestablish compositional ranges and minimum static proper-ties, having occasional special requirements, such as fatigueor corrosion requirements. However, in the age where dig-ital representation and transfer of information is the norm,the complexities of extracting key microstructural and lim-iting parameters from certified material-lot samples, in anefficient manner, remain formidable. Even if such meth-ods existed, the sheer magnitude of data overwhelms humancapacity to reduce sufficient information for decision sup-port. Therefore, a disciplined approach to data managementemploying digital, machine-based methods and frameworksare essential to reach MBMD goals. It is important to havedata management plans during development and produc-tion deployment of materials. Use of MBMDs, drawingon well-structured digital data, can and should be used todrive the identification of critical test locations and testtypes to represent the entirety of a component and materialcapability.

    Once material and process specifications have beenestablished, a complete set of material property allowablesare developed and are captured in company-proprietaryinternal engineering documents. Within the jet engineindustry statistically-based property allowables are devel-oped, whereas within the airframe industry mean propertiesare often used in conjunction with design safety factors anddesign life scatter factors to account for behavior below themean. Sometimes, the allowables are communicated withinindustry-wide manuals, such as the Metallic Materials Prop-erties Development and Standardization (MMPDS) manual,or the Composite Materials Handbook, CMH-17 [6, 7], intabular or design-curve formats. From the statistically-basedminimum-property values, formalized design methods (e.g.,allowable stress versus temperature, Larsen-Miller curves,and Goodman diagrams, etc.) are employed that draw onstatistically determined minimum property capabilities forthis new material. Importantly, the design and qualificationprocesses are intentionally conservative and treat materi-als by continuum mechanics analysis (for metallics) basedon allowable expected properties. Thus, in general, compo-nents are designed assuming uniform, minimum (“worst-of-the-worst”) properties throughout a component.

    When selecting materials and specimens for propertycapability testing, one typically uses a wide range of spatiallocations within a manufactured component. Differencesin mechanical properties from samples obtained from dis-parate locations within a component volume are typicallytreated as variability, instead of as normal microstruc-ture dependent differences. For statistical purposes, thislocation–specific “scatter” within components is then ana-lyzed as a part of the single population used to establishminimum design-property values. This is the case presentedin Fig. 2 having all test data being assumed to be the

    4 Distribution A. Approved for public release (PA): distribution unlimited.

  • Integr Mater Manuf Innov (2017) 6:249–263 253

    same property capability as an integral part of the overalldefinition assumption. In other words, property variabil-ity across a component has been most often treated bydesigners as though it were a condition of aleatory uncer-tainty (inherent randomness) when in fact it is more appro-priately described as epistemic uncertainty (limited by ourability to describe). However, materials engineers are nowable to reduce epistemic uncertainty for location-specificdesign through predictive modeling. Obviously, this prac-tice of combining location dependent, different materialbehavior into a single population of material performancevalues adds scatter to the population and thus conservatismto the design allowables. Pragmatic methods such as ‘gaugebracketing’ are often used to sub-divide minum proper-ties for mill products (plates, sheets, bars, rods, etc.) basedsolely on product form cross-sectional dimensions, whichminimizes this issue, but results in a chemistry, process,geometry, property based material definition.

    Limitations of the TraditionalRequirements-Based Approach

    Traditional verification of static material definitionsincludes material specifications and empirical designcurves. Standard test methods are applied to enable prag-matic evaluation of material to assess its equivalency to thatof the materials used to generate the associated specifica-tion. ASTM International has established numerous meth-ods for measurement of chemistry, structure and mechanicalproperties. These methods largely describe how to test andanalyze material for compliance to material specifications.Note, however, that so far those methods are not welldeveloped for obtaining property values by material zone,location or component feature, especially if the zone/featuresizes are smaller than test specimen standards. This currentstate is a barrier for better coupling testing to materials mod-els. This becomes particularly troublesome when one rec-ognizes that many engineering structures are designed andmanufactured from materials that are produced at dimen-sions smaller than those required for standardized ASTMtests (for example turbine airfoil wall cross-sections).

    Current quality control and material analysis methodsonly provide for a level of comparison to ensure complianceof a material to a specification, that often includes non-destructive inspection requirements. Specifications oftenignore microstructure, or place minimal requirements onparameters such as grain size or volume fraction of phases,typically as average values only. Single crystal turbineblades, because of their extreme performance require-ments, are an exception to this practice. Almost univer-sally, such parameters are those obtained via traditionallight microscopy and do not take advantage of the more

    sophisticated materials characterization capabilities of thelast few decades. This limits microstructure feature resolu-tion to around 1 micron. By default, statistical metrics ofmicrostructural features, where distribution extremes oftencontrol dynamic properties, are not commonly incorporatedinto industrial specifications and associated quality controlrequirements. To some degree, this is due to the fact that sin-gle material specifications are used across multiple suppli-ers, industries, and applications of varying design criticality.Not all of these uses warrant sophisticated characterization,the associated changes to engineering workflows, and thecost impacts that microstructure specification would typi-cally demand. Thus, the status quo for material propertyand microstructure definitions does not include physics-based mechanisms that truly drive mechanical propertyand component behavior. In large part, this is because themicrostructural features and heterogeneities that drive mate-rial behavior occur at length scales that are microscopic orare complex, and require characterization techniques thatare thought to take too much time, not readily available, andrequire specialized skills to obtain and interpret.

    Also, present day specifications typically begin with acomposition range and specified properties of the finalproduced material. Specifications for the process are onlyprogressively refined as needed so as to give materialsproducers and component suppliers as much freedom aspossible to alter processes for cost control. However, Fig. 2suggests that properties can vary for cause (physics-basedmechanisms) that are tied to manufactured geometries andprocessing details, and they are spatially varied in a non-random way. The distribution of properties by location isshown below the forging shape, with each narrow distribu-tion profile representing the behavior of a specific region.Note that there is significant variation in properties withinboth the forged shape as well as the final machined part.However, as previously noted for most current design prac-tices, property domains are sampled without regard to loca-tion, essentially assuming that all tested variation is randomvariation (though, it is common to create “gauge breaks” orsection-size criteria in regular mill product forms, where itis assumed process controls provide reproducible spatiallydistributed properties within section-size). This aggregatedsampling of properties can lead to a statistical representationthat extends the tails of the aggregated property curve in anoverly conservative fashion. The result is underutilization ofmaterial capability and therefore sub-optimized componentdesign if all material tests are assumed to be the same, andthe variations are assumed to arise from random scatter.

    Once a material having a traditional static, empirical def-inition is assigned to a new component design, the compo-nent is assumed to have the same set of minimum propertiesthroughout the component volume, often regardless of pro-cessing path or testing orientation. For some materials and

    5 Distribution A. Approved for public release (PA): distribution unlimited.

  • 254 Integr Mater Manuf Innov (2017) 6:249–263

    processes, such as rolled sheet materials, anisotropy is rep-resented by property measurements parallel- and transverse-to the rolling direction. Only rarely are more sophisticatedmeasures of anisotropy, such as crystallographic texture,included in material definitions and design systems. The“homogeneous and isotropic” assumption also drives thetesting and qualification process for new components. Loca-tions of components that are deemed to be most demandingto a given application are often chosen for qualification test-ing. Test plans for a new component are then formalized andexecuted and equivalency of the material tested to the qual-ity requirements, specification, and ultimately the designcurves, is then assessed. One can see that this method forobtaining materials definitions inherently ties the definitionsto a specific application space and demands that defini-tions be re-established for every change in application space(component configuration or utilization environment). Thetraditional material definitions are simply not flexible norportable.

    Traditional material definitions and associated mechani-cal properties derived from coupons are surrogates for othermaterial with the same chemistry and structure. Couponsfrom a sub-scale test article may not provide the equiva-lent structure that may be present in a larger componentmade from the same material, for example. This means thatthe material definition must include specific chemistry andstructural feature descriptions that bound the application ofthe empirical test data design curves. For materials that areapplied to many component configurations, which resultin manufacturing path differences, there then is a need todevelop new, individual empirical design systems. In theMBMD approach, models that cover the entire applicationspace for the material can be successfully established andapplied to a wide range of components.

    It is important to understand the further limitations ofmaterials defined by this traditional approach to the rangeof the potential design or application space. Under this prac-tice, it may be possible that the initially sampled scale-upcomponent configurations or processing methods do notrepresent the design space for a final new component con-figuration. As such, simply applying qualification testingfor selected experience-based locations to represent compo-nent challenges, may miss potential challenges for the newcomponent. Also, alternate processing methods to achieveequivalency to the original empirical-based definition maybe missed, regardless of application demands set on spe-cific locations. It is also possible that standard test plansidentify test locations that are of little actual use in discrim-inating material behavior, while locations of steep structureand property gradients may be overlooked. To ensure con-servatism, large numbers of test locations and quantities oftests are required to qualify new component configurations

    or processing methods used to produce components from atraditionally defined material. The number of tests requiredcan range into the thousands, depending on the size anddesign criticality of the component. Use of models isrequired to systematically define test locations of greatestvalue in determining overall component and material equiv-alency. Such a formalized infrastructure and workflow hasbeen recently demonstrated for the specification, modelingand critical testing of bulk residual stresses developed andcontrolled within heat treat quenching processes [8].

    Employing a Model-Based Approach

    Models for Material and Component Design

    We know, in fact, that material properties are generally notuniform throughout a manufactured component; rather theyare path-dependent and location-specific. They are the resultof process path-dependent physical mechanisms, such aslocal recrystallization, grain growth, rate of precipitation orgrowth of precipitates or other phase transformation mech-anisms for example. It is proposed that location-specificdefinitions of material microstructure should be appliedto provide needed chemistry-processing-structure-propertyrelationship information for design, and this informationshould not be lost within an assumption of random scatterfrom sampling various regions of a part. This means thatmodels for deriving material structure from processing, andfor defining properties as a function of materials structure,form the backbone of MBMDs. Figure 3 shows an exam-ple processing, structure, property, performance map thatdepicts relationships and associated model linkages. Themodels need to operate within simulation environments thattrack spatio-temporal variations in materials chemistry, aswell as the location-specific variations in process history.

    Toward this end, DARPA sponsored a unique programin the early 2000’s that was targeted at demonstratingthe feasibility of decreasing the time needed for mate-rial development through the use of computational materi-als engineering tools and methods. The program, entitledAccelerated Insertion of Materials (AIM), was success-ful in demonstrating the feasibility of using physics–basedmodels to develop and optimize materials and associatedcomponents. An overall framework for linking processing-structure-property-performance parameters was establishedand further demonstrated by many researchers and organiza-tions [9–11]. Figure 3 shows an example of an AIM designmap established for an advanced steel [9]. This systematicapproach for materials design enables the co-developmentof a MBMD that can be used within design, structural analy-sis, lifing, manufacturing and quality control functions. The

    6 Distribution A. Approved for public release (PA): distribution unlimited.

  • Integr Mater Manuf Innov (2017) 6:249–263 255

    Fig. 3 Processing-Structure-Property-Performance map that is at the heart of AIM design strategies

    approach maps out the relationships that need to be repre-sented within materials models, or when specific models donot exist, by measured materials data.

    The transition from a static, empirically generated designminimum property to a MBMD will require advanced mod-els and simulations for mechanical properties based onchemistry and spatio–temporal hierarchical materials struc-ture (including heterogeneities or defect structure), togetherwith their parameterization and validation protocols. Asstructure is path dependent, this approach requires accu-rate simulations that provide representations of location–specific structure resulting from manufacturing processesfor the geometry or geometries being considered for thefinal component application, and the consequences of possi-ble heterogeneities occurring at those locations. Our abilityto model and simulate thermomechanical processes hasprogressed rapidly over the past couple decades, allow-ing reasonably high fidelity prediction of spatially varyingmechanical properties for specific well–characterized mate-rials and processes. As an example, Figs. 2 and 4 depictthe results of a forging simulation where the color contoursdepict the gradient of mechanical properties through theforging and final machined components [12, 13].

    In Fig. 4, like Fig. 2, a component’s location-specificproperties have been simulated based on path-dependentevolution of structure. These contours of predicted mechan-ical properties were shown to be accurate and, to the levelof uncertainty, enable application to new component designoptimization functions. These examples are for the nominal

    alloy composition of Ti-6-4, although the MBMD includescritical elements, such as oxygen, iron, and hydrogen. TheMBMD provides predictive capabilities for this materialbased on chemistry and microstructure through simulationof manufacturing processing sequences, including forgingand heat treatment. Unlike the AMS4928 specification,this MBMD enables prediction of unique location-specificproperties. Design for Variation (DFV) methods [14] allowfor local minimum property variations (from both simula-tion predictions and measurements) based on uncertainty ofchemistry and processing conditions (Fig. 5). This type ofMBMD can also help explore alloy chemistry sensitivity

    Fig. 4 Prediction of location-specific property distribution within aTi-6-4 component

    7 Distribution A. Approved for public release (PA): distribution unlimited.

  • 256 Integr Mater Manuf Innov (2017) 6:249–263

    Fig. 5 Monte-Carlo prediction of the mechanical properties for a sin-gle location within a Ti64 component. This approach can enable aneffective approach for location-specific minimum property prediction

    and can aid in driving specific chemistry specifications.Figure 6 shows the sensitivity of the mechanical propertiesof a nominal Ti-6-4 alloy to variations in specific alloyingelements. Advanced mechanical properties have been suc-cessfully modeled as a function of microstructure as shownin Fig. 7 [15].

    The use of physics-based material and process models todefine and predict properties of a volume of material withina component design allows for optimization and maximumuse of a material’s capability and provides direct guidancerelative to critical test locations for validation and qualifi-cation, or model-guided testing. DFV methods have been

    Fig. 6 Modeling tools can enable assessment of mechanical propertysensitivities as a function of specific alloy chemistry. In this exam-ple for a nominal Ti-6-4 alloy, the alloy composition has a significantimpact on component properties. Iron and oxygen content are indepen-dently varied with all other elements and material conditions held atnominal values

    0 69 138 207 276 345 414 483 552 621

    552

    0

    69

    138

    207

    276

    345

    414

    483

    621

    Actual Alterna�ng HCF Strength (MPa)

    Pred

    icte

    d Al

    tern

    a�ng

    HCF

    Str

    engt

    h (M

    Pa)

    R2 = 0.996

    R = 0.8 - 0.7 R = 0.4 - 0.1 R = -0.5 – -1.0

    Fig. 7 Advanced mechanical properties, such as fatigue can be pre-dicted based on microstructure. The capability to predict the fatigueproperties in alpha-beta titanium alloys is shown through the com-parison of measured mechanical properties and those obtained from amicrostructure-based correlative model

    selectively applied in proprietary application to enable engi-neered selection of test locations that provide the mostuseful information relative to capabilities and equivalency[8]. This approach also minimizes non-value added testing,where test results do not provide critical assessment to theMBMD or support further uncertainty quantification for thepredicted component location-specific properties.

    Importantly, the models used to describe the path depen-dency of microstructure evolving from processes and themechanical properties resulting from microstructure shouldbe mechanism-based [16, 17]. Thus, physics-based modelsmust form the foundation for MBMDs. A mechanistic basisestablishes limits for model applicability and suggests tran-sitions to other types of models as the operational environ-ments explored in design impose different mechanistic con-ditions on the materials. For example, it would be of littlevalue to use a model for athermal strength prediction outsidethe range of low temperatures for the actual occurrence ofthe mechanisms it represents. At higher temperatures, mod-els based on thermally-activated creep mechanisms mustbe employed. This requires detailed understanding of theoperative mechanisms, especially within the context of themodel that will represent them. This is where “multi-scale”modeling comes to bear. Multi-scale models are needed todescribe and establish the understanding of the underly-ing mechanisms. Some of these may require first-principlesmodeling [18, 19], or they may be built at meso- and macro-scale levels. Once the operative mechanisms are understoodto the level of acceptable uncertainty, then surrogate modelsor response surfaces may be employed to support integrationof computationally efficient MBE at the component level.

    Location-specific control of chemistry and microstruc-ture will ultimately be the future for MBMDs, where the

    8 Distribution A. Approved for public release (PA): distribution unlimited.

  • Integr Mater Manuf Innov (2017) 6:249–263 257

    features that control damage generation and, to the degreepossible, ultimate failure of a component are containedwithin the model representations. Some of these featuresmay be at the macro-scale (macro-texture), meso-scale(grain flow), micro-scale (grain, precipitate and defect struc-tures) and atomistic-scale (grain boundary elemental seg-regation or compositionally dependent anti-phase bound-ary (APB) energies) [18–20]. Location-specific design andmanufacturing control can and is being linked with proba-bilistic lifing tools and component application-level predic-tions [21]. The ability and application of linking MBMDsand component design discipline tools and methods willenable maximized use of material capabilities and optimalcomponent designs and performance.

    The materials engineering discipline is rapidly advancingtoward physics-based understanding of many materials andmetallurgical phenomena, which are in turn being expressedin model format which will become the backbone of theMBMD paradigm. Since the materials community has longsince expressed materials behavior and property capabilityto other engineering disciplines through empirical testingand reporting approaches, this new approach of providingdesign and structural analysis communities with materialdefinitions in the form of models will result in initial reluc-tance and potential skepticism. To overcome this and enableMBMD integration into other engineering disciplines, thematerials community will need to speak the language ofverification, validation and uncertainty of models, computa-tional codes and output predictions.

    Verification and validation (V&V) are critical elementsof MBMD and must be woven into the process to develop,communicate and use models that will be incorporated aspart of materials definitions. Naturally, the specific proto-cols for V&V need to be tailored to the level of systemrisk that each component and model carries, in order tomanage costs within the MBMD framework. Such tailor-ing demands input from experts within both the materialsand design engineering disciplines. Uncertainty quantifica-tion is a critical element of verification and validation. Thissystematic approach focuses the need for critical, highlysensitive inputs required for successful application of suchmodels. The methodology of careful verification and valida-tion of software and models has been previously described[22] and will enable further understanding by the greaterengineering community. All models, regardless of sophis-tication and fidelity, have finite applicability for particularkinds of designs and given design attributes. For each ofthese, a critical indicator of applicability is the quantifica-tion of the model uncertainty. Thus, the MBMD must con-tain formal uncertainty quantification methods. Knowingand understanding this at the onset is critical.

    Qualification of MBMD approaches and componentsdesigned and manufactured using these approaches will

    rely highly on understanding of the capabilities of modelsthat make up the model-based definition. Industry require-ments and standards will require that MBMD systemsmeet or exceed current levels of uncertainty and proba-bilistic risk. Physics-based understanding of materials andassociated validated models will have an advantage over tra-ditional empirical methods to establish design minima andcan further support intelligent design of component test-ing and monitoring processes, which focus on critical testsand locations that more readily support determination ofmaterial equivalency and component acceptability. The USDepartment of Defense and the Federal Aviation Adminis-tration are assessing and supporting the use of model-basedengineering tools, as with the case for probabilistic lifingmethods.

    Engineering Interoperability and Materials-BasedEngineering Optimization

    As MBMDs are established and used, parametric optimiza-tion of component designs will include location-specificproperties. Through models, this approach directly linkscomponent configuration to potential capability of the com-ponent and local property capabilities, thus permittingmaterials capability and true variation to enter the designoptimization and MBE. The goal is to obtain local prop-erty predictions having quantified uncertainty, and accurateanalyses that represent how the component configurationand processing path control material behavior and com-ponent performance [23]. As material properties are pathdependent, ICME will fully couple manufacturing methodsinto the design process and enable further advantages tobe gained from advancing manufacturing processing meth-ods and controls, which are largely left suboptimal today.MBMD enables complete materials, design, and manufac-turing engineering interoperability, as well as materials-based parametric optimization within the paradigm. That isa marked change from the relatively separated engineeringdomains of today.

    Further, aerospace component design and life-assessment(lifing) methods include probabilistic methods. Such prob-abilistic methods can readily include MBD into the currentframework. Engineering (software) tools such as DARWINcan incorporate location-specific material properties andassociated uncertainties to support further refined proba-bilistic predictions of component and system performance[24].

    Not only is a MBMD able to specify location-specificproperties via simulation, but there are also recent focusedprojects to support MBD through spatially-resolved physi-cal measurements. One example is the US Air Force spon-sored the Foundational Engineering Problems (FEP) pro-gram. Project efforts within that program are demonstrating

    9 Distribution A. Approved for public release (PA): distribution unlimited.

  • 258 Integr Mater Manuf Innov (2017) 6:249–263

    an ability to spatially distribute specific properties through-out a component volume that can support MBMD [8]. Forthis example, bulk residual stress is the material-based fea-ture that is being predicted on a location-specific basis alongwith associated uncertainty quantification, with predictionsthat are supported by location-specific measurements.

    Finally, integration of MBMD into the design commu-nity has been a challenge in the past. However, recentfocused efforts on structure and topological optimization,and associated design tools targeted for advanced manu-facturing methods, such as Additive Manufacturing, haveopened up the world to highly linked, multiple objec-tive function optimization capabilities. These capabilitiescan readily incorporate materials and manufacturing mod-els, and associated path-dependent structure and propertymodels. Many efforts today in Additive Manufacturing areactually employing MBMD through design of materialsand components for additive manufacturing methods. Thesemodel-based tools are being applied to optimization of bothmaterial and component properties. Whether the materialdefinition includes deposition defect prediction capabilitiesand associated impact on mechanical properties, or predic-tions of residual stresses that are built-in to a componentfrom a specific additive manufacturing process, models arebeing used to guide material and component design, andcontrol and monitoring of component manufacturing oper-ations. It is possible to predict the formation of varioustypes of void feature, which in turn enables optimiza-tion of processing path and elimination of unwanted voidfeatures. These same design tools and approaches estab-lished for additive manufacturing can and will be appliedto conventional and emerging processes with legacy andnext-generation materials.

    Model-Based Materials Definition in SustainmentEngineering

    Sustainment engineering is a critical area of systems engi-neering and product life-cycle management. Understandingand defining component and system life is critical for allproduct forms and is largely based on the application spacefor which the component has been designed and the mate-rial from which the component has been produced. Topicssuch as mission life extension and retirement for cause(RFC) are aiming to expand the application space (time ordurability) for fielded components and systems. There areseveral pieces of information required to arrive at optimalsustainment engineering analyses for operational aircraft.First is the as-manufactured state at the component levelin terms of the chemistry-processing-structure-property-performance paradigm. Second is a representation of thetime-resolved operational environment experienced by thecomponent. The acronym “TEST” provides a convenient

    way of summarizing the relevant parameters: Temperature,Environment, Stress, and Time. Third is a description ofthe current material/component state due to operational use,including inspection indications and decisions about themfound during maintenance. Fourth is a relevant MBMD forthe material, manufacturing process, and application. AsMBMDs are enabling spatial resolution and certification ofcomponent properties, it will also be enabling for temporalresolution, and evaluating the consequences of deviationsfrom the initial state developed during service. That is, howwill location-specific properties change as a function oftime and environment of missions? Use of a MBMD willenable identification of critical properties and critical loca-tions within components that will require defined periodicinspections along with mission cycle monitoring to establishan integrated local-life capability understanding.

    In the US Department of Defense, a Technical DataPackage (TDP) is often used to capture and convey prod-uct detail. These electronic drawings provide the shape ofthe component and are annotated with additional metadata“necessary to provide the design, engineering, manufactur-ing, inspection, packaging and quality assurance provisionsinformation necessary to enable the procurement or man-ufacture of an item.” [25]. The most recent definition ofa TDP, defined in MIL-STD-31000A, provides for rep-resentation of components using 3D digital solid models.However, the definition of a TDP is built on a tradi-tional, document-based view of materials, treating compo-nents as having uniform minimum mechanical propertiesthroughout.

    Given a change in the way in which we envision adescription of materials, the current TDP structure is insuf-ficient to fully transmit the detailed digital informationneeded to describe a material for remanufacture or sustain-ment. As an example, industry is beginning to earnestlyrely on modeling of material behavior to inform designand sustainment engineering. Lockheed Martin and Alcoahave recently demonstrated the ability to model the residualstresses created in a large and complex aluminum forgingthrough its various processing steps with requisite fidelity[26]. The resulting model-based, 3D residual stress pro-files are integral to the analysis of these components bydesign engineers, manufacturing engineers, and sustainmentengineers. However, the current TDP paradigm might pos-sibly choose to add this information, or not, as supplementalmaterial within the documentation, and not within the coredigital definition of the component. Furthermore, under cur-rent practice, there are no formal frameworks or standardsfor relating digital models of various types to each other orto the engineered component itself.

    Current structural maintenance practices in the DoD aregenerally based on a measure of engine operating cycles,meaning maintenance is performed at set intervals nearly

    10 Distribution A. Approved for public release (PA): distribution unlimited.

  • Integr Mater Manuf Innov (2017) 6:249–263 259

    regardless of how aggressively the aircraft is flown. Theemerging concepts of Digital Twin and Digital Thread seekto build model-based engineering tools and a supportingdigital infrastructure, respectively, to provide the neededdata and models to shift the maintenance paradigm to onebased on actual use [27]. These emerging concepts fortotal system lifecycle management add to the drivers forMBMDs. With access to a model-based description of amaterial, a part serial number, and digital thread data on air-craft use, sustainment engineers would be able to rapidlyand accurately assess the effects of damage or missionprofile changes onto component health. Additionally, oper-ational systems could serve as flying laboratories, providingcrucial performance data back to materials and design engi-neers in validating lifing models, or providing new insightsfor improvements [28].

    Technical Challenges to Achieving a Model-BasedDefinition of Materials

    Material Volume Elements

    Though it is possible to use MBMD on discrete and spe-cific small volume elements, it is believed to be mostpractical and potentially more appropriate to establishStatistically Equivalent Representative Volume Elements(SERVEs) [29]. SERVEs provide for the ability to use smallvolume elements to represent entire zones of components(larger volumes) deemed to have statistically-equivalentmaterial microstructure and response. The SERVE methodsare grounded within objective and quantitative definitions ofmaterials structure, developing performance models specif-ically tied to those structure definitions, and coupling theresponses of that structure to the simulations of the SERVEresponse. Through the use of SERVEs and direct numeri-cal simulation, the properties of a given part zone are tiedto the distribution of all microstructure features includedin the SERVE, rather than being related only to specificscalar microstructure descriptors, such as average grain sizeor phase volume fraction alone. The specific microstru-ture descriptors linked to the associated failure mechanismsfor the specific material and application must be accountedfor within each SERVE. The established mechanism-basedmaterials behavior models provide guidance toward estab-lishment of iso-property structure definitions that make-upeach SERVE for a material.

    For the SERVE methods and MBMD to be successfulwithin and engineering standard practice or protocol, test-ing methods and requirements need to be adapted for thespecific purposes of model parameterization, validation anduncertainty quantification [22, 23]. This differs somewhatfrom today’s experimental requirements and protocols. For

    example, within today’s common practice, experiments areoften designed to evaluate selected challenging aspects ofcomponent designs. However, within MBMD, the experi-ments need to be designed to evaluate selected challengingaspects of models and SERVES. That requirement changesthe experimental plan, materials and specimen prepara-tion, and the instrumentation used. However, the SERVEapproach has the payoff that the SERVE (models, struc-ture definitions and response tests) become portable to anycomponent that is designed within the applicable validateddomain of the SERVE. Thus, the material is no longeronly defined by its use for a specific application. Rather,the material is defined by its validated model/SERVEframework; hence, it is a model-based definition. Physi-cal property testing of material during initial developmentprovides for the validation of the model-based definitionsand establishes initial uncertainty bounds for simulation-based predictions. Further use of the MBMD and SERVEin successful engineering designs, captures quality datafrom engineered test locations and provides the opportunityfor further enhancement of the MBMD through Bayesianupdating. These in turn can enable further reduction inprediction uncertainty [30].

    Quantifying Structure

    Within the chemistry–processing–structure–property–perfor-mance paradigm, there remains a key barrier: the quantita-tive description of a material’s internal structure to enablethe mathematical linkage between processing and propertiesthrough models. However, new means of quantitative analy-sis to mathematically describe microstructure have recentlybeen developed or are currently under study; for exampleby Niezgoda, Kalidindi, and Groeber and Jackson [31–34].These methods make it possible to represent microstructuralfeatures at all relevant scales, from Guinier-Preston Zones,to majority phases, to grain size, and crystallographic tex-ture. One approach employs an n-point correlation func-tional at features sized from nanometers to millimetersand, of course, multiple characterization methods that areintegrated. Such a function has been described as [33]:

    Microstructure Function:

    m(x, n) =∑

    L

    s

    MLs QL(n)Xs(x) (1)

    QL(n) : orthonormalFourierbasisInfluence Function:

    a(r, n) =∑

    L

    t

    ALt QL(N)xt (r) (2)

    Xs(x) : indicatorbasis

    11 Distribution A. Approved for public release (PA): distribution unlimited.

  • 260 Integr Mater Manuf Innov (2017) 6:249–263

    However, over the past 2 decades, 3D microstructuralcharacterization has also begun to have an impact on modelbuilding and predictions of materials performance [35].Those techniques and enabling new software tools, suchas DREAM.3D, are being developed for automated 3Dmicrostructural feature analysis, providing a means to struc-ture and analyze multi-modal hierarchical, spatial micro-structural and property information [34]. These new toolsseek to provide the quantitative means for addressing theexplicit representation of microstructure and location spe-cific properties needed for design. Within DREAM.3D,the experimental data from measured microstructures, theanalysis tools for processing the microstructure data, thetools for repeatedly and objectively quantifying and ana-lyzing the microstructure, and the tools for representingthe microstructure as a SERVE, all come together withina hierarchical digital environment. Figure 8 shows exam-ples of the quantitative microstructural analysis that is usedregularly to characterize material and enable linkage tostructure-property models in a probabilistic manner. Whilethese software tools and capabilities are in their infancy,they are enabling for the MBMD approach. Thus, for fullimplementation of the MBMD approach, the materials andstructures disciplines will need to work together to under-stand the tools and their limitations, to develop specificationand standards around them, and to fully manage their use inthe engineering design system.

    Finally, recent advances in constitutive modeling, non-destructive evaluation technology and computing powersuggest that it should be possible to develop methods fordefining and certifying materials in a more direct man-ner that measures salient microstructural features (includingheterogeneities) that control the properties of interest,and simulates the consequences of them. Such methods

    could be automated. They would also generate digitalmaterials descriptors, permitting the mathematical descrip-tion of a material, ready for constitutive modeling. Modelscan be used to define needed structure—property testingfor a target level of uncertainty. SERVEs linked to spe-cific microstructural features will drive the level of testingrequired based on the distribution and effectively the tails ofthe distribution of the defined metric.

    Digital Infrastructure

    A model-based engineering approach will require a robustdigital infrastructure within which to securely capture, ana-lyze, store and share data and models throughout a supplychain. For materials and manufacturing, development ofsuch an infrastructure is still in its embryonic stage. Thisis not a new need, and organizations have struggled toeven reach common means to describe digital materialsdata for the past couple decades [36]. However, the rapidmove to a digital economy has added incentive to rein-vigorate this necessary work. In this new paradigm datais ideally both readable by human and machine to max-imize efficiency and information extraction. The require-ment for human and machine readable data relies on well-defined vocabularies, schemas, formats, and ontologies,where ontologies define the relationship between terms andconcepts within a topical area. By providing these defi-nitions, one can provide unambiguous data to a humanand enable a computer to evaluate both complex narra-tive and structured data to extract new information. Someof these concepts that are so important in data science,such as ontologies, are new to the materials communityand relatively little work has been done to date in thisarea [37].

    Fig. 8 Example of statisticallyrelevant microstructurecharacterization of a Ti64 alloymaterial relative to specialcharacteristics of micro-texturedregions (MTR) that havemechanistic impact on materialproperties. Specific features arerequired to be quantified toenable to capture the appropriatestatistics that successfullydescribe MTRs

    0 5 10 15 20 25 30 350

    10002000300040005000600070008000

    Aspect Ra�o

    Freq

    uenc

    y

    0.30

    500

    1000

    1500

    20002500

    Freq

    uenc

    y

    0.4 0.5 0.6 0.7 1.0Density

    0.90.8

    00

    5001000150020002500

    Freq

    uenc

    y

    10 20 30 40 90Stress Axis Misalignment

    605000

    1000

    2000

    3000

    40005000

    Freq

    uenc

    y

    5 10 15 20 35Avg. Misorienta�on

    3025

    3.00

    10002000300040005000

    Freq

    uenc

    y

    3.5 4.0 4.5 5.0 6.5Log MTR Size

    6.05.50.00

    5001000150020002500

    Freq

    uenc

    y

    0.5 1.0 1.5 2.0 3.5MTR Intensity

    3.02.5

    3000

    70 80

    30003500

    4.0

    Texture Metric Distribu�ons for Ti-6Al-4V (rolled plate)

    6000

    12 Distribution A. Approved for public release (PA): distribution unlimited.

  • Integr Mater Manuf Innov (2017) 6:249–263 261

    Importantly, some of the needed methods for handlingcomplex spatio-temporal materials and manufacturing dataare being developed under such tools as DREAM.3D [34].However, agreed upon standards for conveying materialsinformation, such as for microstructure, defects and materialproperties, are still evolving [38–42]. In order to minimizethe barrier to internal data collection, analysis, storage andpublishing, e-Collaboration platforms are being recognizedas essential components of an organization’s infrastructure[43–45]. Collaboration and sharing data and models outsidean organization can become quite complicated due to thesecurity required to protect proprietary information. How-ever, recent industry ICME programs have shown that thesecurity concern can be overcome with careful design of thesoftware platform and security protocols [46].

    Today, material and component properties are measured,collected and communicated from suppliers to customers bymeans of certificates of conformance (certs) that define andvalidate that the component is comprised of material that isequivalent to that used in the design definition. The infras-tructure for communicating and capturing cert informationis currently significantly inadequate. There is no schema orreport format standard. Efforts have been initiated to enableincreasingly seamless transfer of such data in digital formatwithout radical change in data structure and managementat suppliers and customers. Data recognition tools that canautomate the identification, tagging, and parsing of arbitrarymaterial cert data are being developed and will enable asignificant shift in materials data management capabilities.This will make all measured data available for componentand model updating and further capability advancement.

    Living Model-Based Materials Definitionsand Continuous Feedback

    Once a methodology has been developed to seamlessly cap-ture and share materials data and information throughoutthe materials life cycle, one can intuitively see the signif-icant benefits to the community. New models for materialbehavior could be validated much more readily on broadersets of data. Feedback loops could reduce the need for redis-covery of issues and solutions along the entire process andprovide new insight to validity of assumptions made ear-lier in the process. Data analytic techniques could allownew material compositions to be discovered more readily,while operation of systems could effectively become fieldlaboratories used to refine component lifing models usingcomplex and long-term data streams [28, 47, 48]. MBMDsare ideal platforms for continuous improvement and har-vesting of production and operational data for increasedknowledge. The goal of a material definition is to providethe design community with specific capabilities for a givenmaterial along with specific uncertainties. Reincorporation

    of production data from varied component configurationsproduced from myriad methods provides for an opportunityto develop high fidelity models based on rich and varieddata sets. This continuous life-cycle loop of using mecha-nistic models to develop materials and the use of productiondata to further refine the uncertainty of model predictions,provides a framework for a modern multi-scale materi-als and structure infrastructure that beneficially changesthe interactions between design, materials and manufac-turing disciplines. This material, process, and componentdesign infrastructure will enable a continuous improvementprocess of Cradle-to-Cradle learning.

    Summary and Conclusions

    Model-based materials definitions are seen as the next stepin the evolution of engineering disciplines where mate-rials and manufacturing technology and capabilities areintegrally linked to component and systems design andstructural analysis. Use of physics-based materials modelsto define the location-specific properties within compo-nents, based on path-dependent processing methods, willprovide a means to include both materials and manufactur-ing processes into parametric component design processes.Critical elements of this approach will include accuratephysics-based models, automated and noninvasive methodsto quantify microstructure, methods for defining and man-aging the spatio-temporal information, linkage of MBMDsto design processes, engineering test program data, produc-tion certification reports, and in-service performance data tovalidate MBMDs. Many of these critical elements are read-ily available, but some need further development along withmeans to holistically link each element into an auditable,revision controlled, self-consistent design system. A holisticdata and informatics backbone is needed throughout.

    Materials science and engineering tools and methodshave been changing at increasing rates over the past severaldecades. Increases in characterization method capabilitieshave led to greater physics-based understanding of materi-als phenomena and associated mechanisms. Computationalmethods have likewise advanced at unprecedented ratesand are allowing accurate prediction of path-dependentmicrostructural state. By extension, advances in theoreticaland applied mechanics have led to the ability to accuratelypredict a wide range of material properties based on repre-sentative microstructural volume elements. Collectively, itis now possible to predict physical and mechanical prop-erties for near-arbitrary compositions, by through-processmodeling from raw form (e.g., ingot, compact, etc.) throughfinished component. Applying and developing thesecapabilities within an affordable, ubiquitous, and availableinfrastructure remains a challenge as the practice evolves.

    13 Distribution A. Approved for public release (PA): distribution unlimited.

  • 262 Integr Mater Manuf Innov (2017) 6:249–263

    Industry is already taking advantage of modeling toolsand methods [8]. Step-wise introduction of the largerMBMD system would be useful so that it does not createtoo much disruption to standard processes and protocols.There are efforts on-going where MBMD is being appliedin parallel to conventional methods to help understand thebenefits of greater fidelity of material definition and processcontrol. This “soft” use is opening-up eyes to how parts canbe enhanced and to what may not be currently understoodabout parts based on conventional definition methods.

    It is the opinion of the authors that the traditionalapproach to defining a material by chemistry ranges, mate-rial process ranges, and static property minima will migrateto MBMDs, due to the many benefits that result from thisnew capability, including:

    – Development and modification of materials for specificdesign requirements

    – Integration of MBDs into parametric design processes,enabling location-specific properties to be incorporated

    – Maximizing the use of legacy materials via more effi-cient tailoring of processing and properties

    – Elimination of minimum-property focus in materialsdevelopment and application

    – Enabling probabilistic design and component lif-ing methods that include location-specific mechanicalproperty capabilities

    – Condition-based in-service component assessment andmaintenance

    – Engineered test plans that decrease the quantity (andassociated costs) and increase the value of quality certi-fication tests

    – Digital material specifications that are largely mathemat-ical in nature and focused on key microstructural andchemical attributes, instead of sampling test material

    While not specifically developed and discussed in thismanuscript, the authors also see benefits to applyingMBMD in the following areas:

    – Improved material quality and reduced rejection rates– Simpler and more rapid heat lot / batch certifications for

    shipment– More rapid facility and product qualification demon-

    strations– More rapid field-based service inspections and repair

    validation

    Acknowledgements The authors wish to thank V. Venkatesh, Prattand Whitney, P. Kobryn, Air Force Research Laboratory, for valuableconversations that helped inspire this paper.

    Open Access This article is distributed under the terms of theCreative Commons Attribution 4.0 International License (http://creativecommons.org/licenses/by/4.0/), which permits unrestricteduse, distribution, and reproduction in any medium, provided you give

    appropriate credit to the original author(s) and the source, provide alink to the Creative Commons license, and indicate if changes were made.

    References

    1. National Defense Industrial Association (2011) Final report,Model-based engineering, NDIA M and S, Feb. 2011

    2. Whittenburg M, Whittenburg R (2013) Using MIL-STD-31000ato support better buying power 2.0, contract management, October2013, 32–43

    3. Committee On Integrated Computational Engineering (2008) Inte-grated computational materials engineering: a transformationaldiscipline for improved competitiveness and national security.National Academies Press, Washington, DC

    4. The White House (2011) The materials genome initiative. https://obamawhitehouse.archives.gov/sites/default/files/microsites/ostp/materials genome initiative-final.pdf. Accessed 21 March 2017

    5. Furrer D, Liu X, Naik R, Venkatesh V (2016) Model-based mate-rials definitions for design and structural analysis. Paper presentedat the Annual Meeting of The Minerals, Metals, and MaterialsSociety, Nashville, TN, 15–18 February 2016

    6. Battelle Memorial Institute (2016) Metallic materials propertiesdevelopment and standardization (MMPDS), https://www.mmpds.org/ Accessed 4 March 2017

    7. Wichita State University (2016) Composite materials handbook,http://www.cmh17.org/. Accessed 24 March 2017

    8. Cernatescu I, Venkatesh V, Glanovsky JL, Landry LH, Green RN,Gynther D, Furrer DU, Turner TJ (2015) Residual stress mea-surements implementation in model validation process as appliedin the United States Air Force foundational engineering prob-lem program on ICME of bulk residual stress in Ni Rotors. In:56th AIAA/ASCE/AHS/ASC structures, structural dynamics, andmaterials conference, AIAA SciTech Forum, Kissimmee, FL, 5–9January 2015. https://doi.org/10.2514/6.2025-0387

    9. Olson GB (1997) Computational design of hierarchically struc-tured materials. Science 277:1237–1242. https://doi.org/10.1126/science.277.5330.1237

    10. Reed RC, Tao T, Warnken N (2009) Alloys-by-design: appli-cation to nickel-based single crystal superalloys. Acta Mater57(19):5898–5913. https://doi.org/10.1016/j.actamat.2009.08.018

    11. Allison J, Li M, Wolverton C, Su X (2006) Virtual aluminumcastings: an industrial application of ICME. JOM 58(11):28–35.https://doi.org/10.1007/s11837-006-0224-4

    12. Furrer D, Chatterjee A, Shen AG, Semiatin SL, Miller J, GlavicicM, Goetz R, Barker D (2007) Development and applicationof microstructure and mechanical property models for titaniumalloys. In: Minomi M, Akiyama S, Ikeda M, Hagiwara M,Maruyama K (eds) Ti2007 science and technology, the Japaninstitute of metals, pp 781–788

    13. Glavicic MG, Venkatesh V (2014) Integrated computational mate-rials engineering of titanium: current capabilities being developedunder the metals affordability initiative. JOM 66(7):1310–1320.https://doi.org/10.1007/s11837-014-1013-0

    14. Reinman G, Ayer T, Davan T, Devore M, Finley S, GlanovskyJ, Gray L, Hall B, Jones C, Learned A, Mesaros E, MorrisR, Pinero S, Russo R, Stearns E, Teicholz M, Teslik-Welz W,Yudichak D (2012) Design for variation. Qual Eng 24(2):317–345.https://doi.org/10.1080/08982112.2012.651973

    15. Adams P (2012) Presented at Aeromat, Charlotte, NC, June 19, 201216. Furrer DU (2011) Application of phase-field modeling to indus-

    trial materials and manufacturing processes. Curr Opinion SolidState Mater Sci 15(3):134–140. https://doi.org/10.1016/j.cossms.2011.03.001

    14 Distribution A. Approved for public release (PA): distribution unlimited.

    http://creativecommons.org/licenses/by/4.0/http://creativecommons.org/licenses/by/4.0/https://obamawhitehouse.archives.gov/sites/default/files/microsites/ostp/materials_genome_initiative-final.pdfhttps://obamawhitehouse.archives.gov/sites/default/files/microsites/ostp/materials_genome_initiative-final.pdfhttps://obamawhitehouse.archives.gov/sites/default/files/microsites/ostp/materials_genome_initiative-final.pdfhttps://www.mmpds.org/https://www.mmpds.org/http://www.cmh17.org/https://doi.org/10.2514/6.2025-0387https://doi.org/10.1126/science.277.5330.1237https://doi.org/10.1126/science.277.5330.1237https://doi.org/10.1016/j.actamat.2009.08.018https://doi.org/10.1007/s11837-006-0224-4https://doi.org/10.1007/s11837-014-1013-0https://doi.org/10.1080/08982112.2012.651973https://doi.org/10.1016/j.cossms.2011.03.001https://doi.org/10.1016/j.cossms.2011.03.001

  • Integr Mater Manuf Innov (2017) 6:249–263 263

    17. Sangid MD, Sehitoglu H, Maier HJ, Furrer DU, Glavicic MG,Stillinger J (2012) Role of microstructure in predicting fatigueperformance. In: 53rd AIAA/ASME/ASCE/AHS/ASC structures,structural dynamics and materials conference, 23–26 April 2012,Honolulu, Hawaii

    18. Gorbatov OI, Lomaev IL, Gornostyrev YN, Ruban AV, Furrer D,Venkatesh V, Novikov DL, Burlatsky SF (2016) Effect of com-position on antiphase boundary energy in Ni3Al based alloys: abinitio calculations. Phys Rev B 93:224106

    19. Woodward C (2011) Ab-initio molecular dynamics simulation ofmolten Ni-based superalloys. AFRL-RX-WP-TP-2011-4370 airforce research laboratory. OH, Wright-Patterson AFB. http://dtic.mil/cgi-bin/GetTRDoc?AD=ADA553357, Accessed 15 May 2017

    20. Rugg D, Furrer D, Brewitt N (2008) Textures in titanium alloys—an industrial perspective on deformation. In: Rollett AD (ed)American ceramics society, ceramic transactions, volume 200, acollection of papers presented at the 15th international conferenceon texture of materials (ICOTOM 15), June 1–6, 2008, Pittsburgh,Pennsylvania, pp 521–533

    21. Enright MP, McFarland J, McClung R, Wu W-T, Shankar R (2013)Probabilistic integration of material process modeling and fracturerisk assessment using gaussian process models. In: 54thAIAA/ASME/ASCE/AHS/ASC structures, structural dynamics,and materials conference, Boston. https://doi.org/10.2514/6.2013-1851

    22. Cowles BA, Backman DG, Dutton RE (2015) Update to rec-ommended best practice for verification and validation of ICMEmethods and models for aerospace applications. Integrating MaterManuf Innov 4:2. https://doi.org/10.1186/s40192-014-0030-8

    23. Panchal JH, Kalidindi SR, McDowell DL (2013) Key computa-tional modeling issues in integrated computational materials engi-neering. Comput Aided Des 45:4–25. https://doi.org/10.1016/j.cad.2012.06.006

    24. Chan KS, Moody J (2016) A Hydrogen-Induced decohesionmodel for treating cold dwell fatigue in Ti-Based alloys. MetallMater Trans A 47A:2058–2072. https://doi.org/10.1007/s11661-016-3367-0

    25. Department of Defense (2013) Standard practice, Technical datapackages. MIL-STD-31000A, 26 February 2013

    26. Ball DL, James MA, Bucci R, Watton J, DeWald AT, Hill MR,Popelar CF, Bhamidipati V, McClung RC (2015) The impact offorging residual stress on fatigue in aluminum, SciTech 2015,Kissimmee, Florida, 5–9 January 2015

    27. Kobryn P, Tuegel E, Zweber J, Kolonay R (2017) Digital threadand twin for systems engineering: EMD to disposal. In: 55thAIAA aerospace sciences meeting 9–13 January 2017, Grapevine.https://doi.org/10.2514/6.2017-0876

    28. Larsen JM, Jha SK, Szczepanski CJ, Caton MJ, John R, Rosen-berger AH, Buchanan DJ, Golden PJ, Jira JR (2013) Reducinguncertainty in fatigue life limits of turbine engine alloys. Int JFatigue 57:103–112

    29. Ghosh S, Dimiduk DM (eds) (2011) Computational methods formicrostructure-property relationships. Springer, Berlin

    30. Kennedy MC, O’Hagan A (2001) Bayesian calibration of com-puter models. J R Stat Soc Ser B (Stat Methodol) 63(3):425–464.https://doi.org/10.1111/1467-9868.00294

    31. Niezgoda SR, Yabansu YC, Kalidindi SR (2011) Understandingand visualizing microstructure and microstructure variance as astochastic process. Acta Mater 59:6387–6400

    32. Niezgoda SR, Kanjarla AK, Kalidindi SR (2013) Novel microstruc-ture quantification framework for databasing, visualization, andanalysis of microstructure data. Integrating Mater Manuf Innov2:3. https://doi.org/10.1186/2193-9772-2-3

    33. Kalidindi SR (2016) Hierarchical materials informatics.Butterworth-Heinemann, ISBN: 9780124103948

    34. Groeber MA, Jackson MA (2014) DREAM. 3D: a digital represen-tation environment for the analysis of microstructure in 3D. Integra-ting Mater Manuf Innov 3(5). https://doi.org/10.1186/2193-9772-3-5

    35. Kral M, Spanos G (1999) Three-dimensional analysis of proeutec-toid cementite precipitates. Acta Metall 47(2):711–724

    36. Rumble J (2014) E-materials data. ASTM international. Standard-ization news, http://www.astm.org/standardization-news/perspective/ematerials-data-ma14.html. Accessed 22 March 2017

    37. Cheung K, Hunter J, Drennan J (2009) Matseek: an ontology-based federated search interface for materials scientists. IEEEIntell Syst 24:47–56. https://doi.org/10.1109/MIS.2009.13

    38. Austin T, Bullough C, Gagliardi D, Leal D, Loveday M(2013) Prenormative research into standard messaging formatsfor engineering materials data. Int J Digit Curation 8(1):5–13.https://doi.org/10.2218/ijdc.v8i1.245

    39. Michel K, Meredig B (2016) Beyond bulk single crystals: a dataformat for all materials structure–property–processing relation-ships. MRS Bull 41(8):617–623

    40. Diehl M, Eisenlohr P, Zhang C, Nastola J, Shanthraj P, Rot-ers F (2017) A flexible and efficient output file format for grainscale multiphysics simulations. Integrating Mater Manuf Innov.https://doi.org/10.1007/s40192-017-0084-5

    41. Schmitz G, Prahl U, Farivar H (2017) Scenario for data exchangeat the microstructure scale. Integrating Mater Manuf Innov.https://doi.org/10.1007/s40192-017-0092-5

    42. MATerials Innovation Network (2017) Georgia tech institute formaterials, Georgia institute of technology. https://matin.gatech.edu/. Accessed 15 May 2017

    43. Jacobsen MD, Fourman JR, Porter KM, Wirrig EA, BenedictMD, Foster BJ, Ward CH (2016) Creating an integrated collabora-tive environment for materials research. Integrating Mater ManufInnov 5:12. https://doi.org/10.1186/s40192-016-0055-2

    44. Carey NS, Budavári T, Daphalapurkar N, Ramesh KT (2016) Dataintegration for materials research. Integrating Mater Manuf Innov5:7. https://doi.org/10.1186/s40192-016-0049-0

    45. Puchala B, Tarcea G, Marquis EA, Hedstrom M, Jagadish HV,Allison JE (2016) The materials commons: a collaboration plat-form and information repository for the global materials commu-nity. JOM 68. https://doi.org/10.1007/s11837-016-1998-7

    46. Metals Affordability Consortium (2017) MAIHub. https://maihub.org/. Accessed 24 January 2017

    47. Kalidindi SR (2015) Data science and cyberinfrastructure: criticalenablers for accelerated development of hierarchical materials. IntMater Rev 60(3):150–168

    48. Kalidindi SR, de Graef M (2015) Materials data science: cur-rent status and future outlook. Annu Rev Mater Res 45:171–193.https://doi.org/10.1146/annurev-matsci-070214-020844

    15 Distribution A. Approved for public release (PA): distribution unlimited.

    http://dtic.mil/cgi-bin/GetTRDoc?AD=ADA553357http://dtic.mil/cgi-bin/GetTRDoc?AD=ADA553357https://doi.org/10.2514/6.2013-1851https://doi.org/10.2514/6.2013-1851https://doi.org/10.1186/s40192-014-0030-8https://doi.org/10.1016/j.cad.2012.06.006https://doi.org/10.1016/j.cad.2012.06.006https://doi.org/10.1007/s11661-016-3367-0https://doi.org/10.1007/s11661-016-3367-0https://doi.org/10.2514/6.2017-0876https://doi.org/10.1111/1467-9868.00294https://doi.org/10.1186/2193-9772-2-3https://doi.org/10.1186/2193-9772-3-5http://www.astm.org/standardization-news/perspective/ematerials-data-ma14.htmlhttp://www.astm.org/standardization-news/perspective/ematerials-data-ma14.htmlhttps://doi.org/10.1109/MIS.2009.13https://doi.org/10.2218/ijdc.v8i1.245https://doi.org/10.1007/s40192-017-0084-5https://doi.org/10.1007/s40192-017-0092-5https://matin.gatech.edu/https://matin.gatech.edu/https://doi.org/10.1186/s40192-016-0055-2https://doi.org/10.1186/s40192-016-0049-0https://doi.org/10.1007/s11837-016-1998-7https://maihub.org/https://maihub.org/https://doi.org/10.1146/annurev-matsci-070214-020844

    AFRL-RX-WP-JA-2017-0365JA 2017-0365.pdfMaking the Case for a Model-Based Definition of Engineering MaterialsAbstractIntroductionThe Traditional Process for Representing Materials Information in Design and ManufactureLimitations of the Traditional Requirements-Based ApproachEmploying a Model-Based ApproachModels for Material and Component DesignEngineering Interoperability and Materials-Based Engineering OptimizationModel-Based Materials Definition in Sustainment Engineering

    Technical Challenges to Achieving a Model-Based Definition of MaterialsMaterial Volume ElementsQuantifying StructureDigital InfrastructureLiving Model-Based Materials Definitions and Continuous Feedback

    Summary and ConclusionsAcknowledgementsOpen AccessReferences