Abstract
This work develops a systematic uncertainty quantification framework to assess the reliability of prediction delivered by physics-based material models in the presence of incomplete measurement data and modeling error. The framework consists of global sensitivity analysis, Bayesian inference, and forward propagation of uncertainty through the computational model. The implementation of this framework on a new multiphase model of novel porous silica aerogel materials is demonstrated to predict the thermomechanical performances of a building envelope insulation component. The uncertainty analyses rely on sampling methods, including Markov-chain Monte Carlo and a mixed finite element solution of the multiphase model. Notable features of this work are investigating a new noise model within the Bayesian inversion to prevent biased estimations and characterizing various sources of uncertainty, such as measurements variabilities, model inadequacy in capturing microstructural randomness, and modeling errors incurred by the theoretical model and numerical solutions.
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Notes
Throughout this section we use the abbreviated notation \(\sum _{\alpha }=\sum _{\alpha =1}^{M}\).
References
Alhawari A, Mukhopadhyaya P (2018) Thermal bridges in building envelopes—an overview of impacts and solutions. Int Rev Appl Sci Eng 9(1):31–40
Alnæs MS, Blechta J, Hake J, Johansson A, Kehlet B, Logg A, Richardson C, Ring J, Rognes ME, Wells GN (2015) The FEniCS project version 1.5. Arch Numer Softw 3(100):9–23
An L, Liang B, Guo Z, Wang J, Li C, Huang Y, Hu Y, Li Z, Armstrong JN, Zhou C et al (2021) Wearable aramid-ceramic aerogel composite for harsh environment. Adv Eng Mater 23(3):2001169
An L, Petit D, Di Luigi M, Sheng A, Huang Y, Hu Y, Li Z, Ren S (2021) Reflective paint consisting of mesoporous silica aerogel and Titania nanoparticles for thermal management. ACS Appl Nano Mater 4:6357–6363
An L, Wang J, Petit D, Armstrong JN, Hanson K, Hamilton J, Souza M, Zhao D, Li C, Liu Y et al (2020) An all-ceramic, anisotropic, and flexible aerogel insulation material. Nano Lett 20(5):3828–3835
Berardi U (2017) The benefits of using aerogel-enhanced systems in building retrofits. Energy Procedia 134:626–635
Biot MA (1955) Theory of elasticity and consolidation for a porous anisotropic solid. J Appl Phys 26(2):182–185
Bowen RM (1980) Incompressible porous media models by use of the theory of mixtures. Int J Eng Sci 18(9):1129–1148
Bruggi M, Cinquini C (2011) Topology optimization for thermal insulation: an application to building engineering. Eng Optim 43(11):1223–1242
Chen Z, Wang X, Atkinson A, Brandon N (2016) Spherical indentation of porous ceramics: elasticity and hardness. J Eur Ceram Soc 36(6):1435–1445
Cuce E, Cuce PM, Wood CJ, Riffat SB (2014) Toward aerogel based thermal superinsulation in buildings: a comprehensive review. Renew Sustain Energy Rev 34:273–299
Dalbey K, Eldred MS, Geraci G, Jakeman JD, Maupin KA, Monschke JA, Seidl DT, Swiler LP, Tran A, Menhorn F et al (2020) Dakota, a multilevel parallel object-oriented framework for design optimization parameter estimation uncertainty quantification and sensitivity analysis: Version 6.12 theory manual. Technical report, Sandia National Lab.(SNL-NM), Albuquerque, NM (United States)
De Boer R (2012) Theory of porous media: highlights in historical development and current state. Springer, Berlin
Dehghannasiri R, Xue D, Balachandran PV, Yousefi MR, Dalton LA, Lookman T, Dougherty ER (2017) Optimal experimental design for materials discovery. Comput Mater Sci 129:311–322
Ding C, Tamma KK, Lian H, Ding Y, Dodwell TJ, Bordas SP (2021) Uncertainty quantification of spatially uncorrelated loads with a reduced-order stochastic isogeometric method. Comput Mech 67(5):1255–1271
Eringen AC, Ingram JD (1965) A continuum theory of chemically reacting media-I. Int J Eng Sci 3(2):197–212
Faghihi D, Feng X, Lima EA, Oden JT, Yankeelov TE (2020) A coupled mass transport and deformation theory of multi-constituent tumor growth. J Mech Phys Solids 139:103936
Faghihi D, Sarkar S, Naderi M, Rankin JE, Hackel L, Iyyer N (2018) A probabilistic design method for fatigue life of metallic component. ASCE-ASME J Risk Uncertain Eng Syst Part B Mech Eng 4(3):031005
Faghihi D, Voyiadjis GZ (2012) Determination of nanoindentation size effects and variable material intrinsic length scale for body-centered cubic metals. Mech Mater 44:189–211
Faghihi D, Voyiadjis GZ (2012) Thermal and mechanical responses of BCC metals to the fast-transient process in small volumes. J Nanomech Micromech 2(3):29–41
Faghihi D, Voyiadjis GZ (2014) A thermodynamic consistent model for coupled strain-gradient plasticity with temperature. J Eng Mater Technol 136(1):011002
Farrell K, Oden JT, Faghihi D (2015) A Bayesian framework for adaptive selection, calibration, and validation of coarse-grained models of atomistic systems. J Comput Phys 295:189–208
Feng Q, Chen K, Ma D, Lin H, Liu Z, Qin S, Luo Y (2018) Synthesis of high specific surface area silica aerogel from rice husk ash via ambient pressure drying. Colloids Surf A 539:399–406
Ferronato M, Castelletto N, Gambolati G (2010) A fully coupled 3-D mixed finite element model of Biot consolidation. J Comput Phys 229(12):4813–4830
Frey S, Martins-Costa M, da Gama SR (1996) On the numerical heat transfer based upon mixture theory. Rev Bras Cienc Mec/J Braz Soc Mech Sci 18(3):282
Gandomkar A, Gray K (2018) Local thermal non-equilibrium in porous media with heat conduction. Int J Heat Mass Transf 124:1212–1216
Gao T, Jelle BP, Gustavsen A, He J (2014) Lightweight and thermally insulating aerogel glass materials. Appl Phys A 117(2):799–808
Gao T, Jelle BP, Gustavsen A, Jacobsen S (2014) Aerogel-incorporated concrete: an experimental study. Constr Build Mater 52:130–136
Gelman A, Rubin DB et al (1992) Inference from iterative simulation using multiple sequences. Stat Sci 7(4):457–472
Goulouti K, De Castro J, Keller T (2016) Aramid/glass fiber-reinforced thermal break-thermal and structural performance. Compos Struct 136:113–123
Guo Z, Yang R, Wang T, An L, Ren S, Zhou C (2021) Cost-effective additive manufacturing of ambient pressure-dried silica aerogel. J Manuf Sci Eng 143(1):011011
Haagenson R, Rajaram H, Allen J (2020) A generalized poroelastic model using FEnics with insights into the Noordbergum effect. Comput Geosci 135:104399
Haga JB, Osnes H, Langtangen HP (2012) Biot’s consolidation, pressure oscillations, elastic locking, low-permeable media, finite elements. Int J Numer Anal Methods Geomech 36(12):1507–1522
Hamel S, Peterman K (2019) Thermal breaks in building envelopes. Struct Sustain
Hastings WK (1970) Monte Carlo sampling methods using Markov chains and their applications. Biometrika 57(1):97–109
He Y-L, Xie T (2015) Advances of thermal conductivity models of nanoscale silica aerogel insulation material. Appl Therm Eng 81:28–50
Homma T, Saltelli A (1996) Importance measures in global sensitivity analysis of nonlinear models. Reliab Eng Syst Saf 52(1):1–17
Honarmandi P, Arroyave R (2017) Using Bayesian framework to calibrate a physically based model describing strain-stress behavior of trip steels. Comput Mater Sci 129:66–81
Honarmandi P, Johnson L, Arroyave R (2020) Bayesian probabilistic prediction of precipitation behavior in Ni-Ti shape memory alloys. Comput Mater Sci 172:109334
Jaynes ET (1982) On the rationale of maximum-entropy methods. Proc IEEE 70(9):939–952
Jaynes ET (2003) Probability theory: the logic of science. Cambridge University Press, Cambridge
Jelle BP, Baetens R, Gustavsen A (2015) Aerogel insulation for building applications. The sol–gel handbook. In: Levy D, Zayat M (eds.) pp 1385–1412
Jha PK, Cao L, Oden JT (2020) Bayesian-based predictions of covid-19 evolution in Texas using multispecies mixture-theoretic continuum models. Comput Mech 66(5):1055–1068
Kaipio J, Kolehmainen V (2013) Approximate marginalization over modeling errors and uncertainties in inverse problems. In: Bayesian theory and applications, pp 644–672
Kaipio J, Somersalo E (2006) Statistical and computational inverse problems, vol 160. Springer, Berlin
Karamikamkar S, Naguib HE, Park CB (2020) Advances in precursor system for silica-based aerogel production toward improved mechanical properties, customized morphology, and multifunctionality: a review. Adv Coll Interface Sci 276:102101
Kennedy MC, O’Hagan A (2001) Bayesian calibration of computer models. J R Stat Soc Ser B (Stat Methodol) 63(3):425–464
Kim H, Inoue J, Kasuya T, Okada M, Nagata K (2020) Bayesian inference of ferrite transformation kinetics from dilatometric measurement. Comput Mater Sci 184:109837
Maleki H, Durães L, Portugal A (2014) An overview on silica aerogels synthesis and different mechanical reinforcing strategies. J Non-Cryst Solids 385:55–74
Matouš K, Geers MG, Kouznetsova VG, Gillman A (2017) A review of predictive nonlinear theories for multiscale modeling of heterogeneous materials. J Comput Phys 330:192–220
Merxhani A (2016) An introduction to linear poroelasticity. arXiv:1607.04274
Metropolis N, Rosenbluth AW, Rosenbluth MN, Teller AH, Teller E (1953) Equation of state calculations by fast computing machines. J Chem Phys 21(6):1087–1092
Niskanen M, Dazel O, Groby J-P, Duclos A, Lähivaara T (2019) Characterising poroelastic materials in the ultrasonic range—a Bayesian approach. J Sound Vib 456:30–48
Oden JT, Babuška I, Faghihi D (2017) Predictive computational science: computer predictions in the presence of uncertainty. In: Encyclopedia of computational mechanics, 2nd edn, pp 1–26
Oden JT, Farrell K, Faghihi D (2015) Estimation of error in observables of coarse-grained models of atomic systems. Adv Model Simul Eng Sci 2(1):1–20
Oden JT, Hawkins A, Prudhomme S (2010) General diffuse-interface theories and an approach to predictive tumor growth modeling. Math Models Methods Appl Sci 20(03):477–517
Oden JT, Moser R, Ghattas O (2010) Computer predictions with quantified uncertainty, part II. SIAM News 43(10):1–4
Oliver TA, Terejanu G, Simmons CS, Moser RD (2015) Validating predictions of unobserved quantities. Comput Methods Appl Mech Eng 283:1310–1335
Oskay C, Su Z, Kapusuzoglu B (2020) Discrete eigenseparation-based reduced order homogenization method for failure modeling of composite materials. Comput Methods Appl Mech Eng 359:112656
Panchal JH, Kalidindi SR, McDowell DL (2013) Key computational modeling issues in integrated computational materials engineering. Comput Aided Des 45(1):4–25
Patki P, Costanzo F (2020) A mixture theory-based finite element formulation for the study of biodegradation of poroelastic scaffolds. Comput Mech 66:351–371
Phillips PJ (2005) Finite element methods in linear poroelasticity: theoretical and computational results. Ph.D. Thesis, The University of Texas at Austin
Phillips PJ, Wheeler MF (2009) Overcoming the problem of locking in linear elasticity and poroelasticity: an heuristic approach. Comput Geosci 13(1):5–12
Prevost JH (1985) Wave propagation in fluid-saturated porous media: an efficient finite element procedure. Int J Soil Dyn Earthq Eng 4(4):183–202
Prudencio E, Bauman P, Faghihi D, Ravi-Chandar K, Oden J (2015) A computational framework for dynamic data-driven material damage control, based on Bayesian inference and model selection. Int J Numer Methods Eng 102(3–4):379–403
Prudencio E, Bauman P, Williams S, Faghihi D, Ravi-Chandar K, Oden J (2014) Real-time inference of stochastic damage in composite materials. Compos B Eng 67:209–219
Rajagopal KR, Tao L (1995) Mechanics of mixtures, vol 35. World Scientific, Singapore
Roberts GO, Rosenthal JS et al (2004) General state space Markov chains and MCMC algorithms. Probab Surv 1:20–71
Saltelli A (2002) Making best use of model evaluations to compute sensitivity indices. Comput Phys Commun 145(2):280–297
Saltelli A, Annoni P, Azzini I, Campolongo F, Ratto M, Tarantola S (2010) Variance based sensitivity analysis of model output. design and estimator for the total sensitivity index. Comput Phys Commun 181(2):259–270
Saltelli A, Chan K, Scott E (2009) Sensitivity analysis. Number no. 2008 in Wiley paperback series. Wiley, New York
Saltelli A, Ratto M, Andres T, Campolongo F, Cariboni J, Gatelli D, Saisana M, Tarantola S (2008) Global sensitivity analysis: the primer. Wiley, New York
Saltelli A, Sobol’ IM (1995) About the use of rank transformation in sensitivity analysis of model output. Reliab Eng Syst Saf 50(3):225–239
Saltelli A, Tarantola S (2002) On the relative importance of input factors in mathematical models. J Am Stat Assoc 97(459):702–709
Singer B, Hyatt S, Drekic S (2013) A Bayesian approach to 2d triple junction modeling. Comput Mater Sci 71:97–100
Sobol’ IM (1990) Sensitivity estimates for nonlinear mathematical models. Mat Model 2:112–118
Sobol’ IM (1993) Sensitivity analysis for non-linear mathematical models. Math Model Comput Exp 1:407–414
Sobol’ IM (2007) Global sensitivity analysis indices for the investigation of nonlinear mathematical models. Mat Model 19:23–24
Song P, Mignolet MP (2019) Maximum entropy-based uncertainty modeling at the elemental level in linear structural and thermal problems. Comput Mech 64(6):1557–1566
Tan J, Villa U, Shamsaei N, Shao S, Zbib HM, Faghihi D (2021) A predictive discrete-continuum multiscale model of plasticity with quantified uncertainty. Int J Plast 138:102935
Topuzi D (2020) Structural thermal breaks. Struct Des
Torquato S, Haslach H Jr (2002) Random heterogeneous materials: microstructure and macroscopic properties. Appl Mech Rev 55(4):B62–B63
Truesdell C (1962) Mechanical basis of diffusion. J Chem Phys 37(10):2336–2344
U.S. Energy Information Administration. https://www.eia.gov/
Van Bommel M, De Haan A (1995) Drying of silica aerogel with supercritical carbon dioxide. J Non-Cryst Solids 186:78–82
Wang C, Mobedi M, Kuwahara F (2019) Simulation of heat transfer in a closed-cell porous media under local thermal non-equilibrium condition. Int J Numer Methods Heat Fluid Flow 30:2478–2500
Wang Y, McDowell DL (2020) Uncertainty quantification in multiscale materials modeling. Woodhead Publishing Limited, Sawston
Wei T-Y, Chang T-F, Lu S-Y, Chang Y-C (2007) Preparation of monolithic silica aerogel of low thermal conductivity by ambient pressure drying. J Am Ceram Soc 90(7):2003–2007
Yang R, Hu F, An L, Armstrong J, Hu Y, Li C, Huang Y, Ren S (2019) A hierarchical mesoporous insulation ceramic. Nano Lett 20(2):1110–1116
Yang Z, Wang Z, Yang Z, Sun Y (2018) Multiscale analysis and computation for coupled conduction, convection and radiation heat transfer problem in porous materials. Appl Math Comput 326:56–74
Zhang W, Bostanabad R, Liang B, Su X, Zeng D, Bessa MA, Wang Y, Chen W, Cao J (2019) A numerical Bayesian-calibrated characterization method for multiscale prepreg preforming simulations with tension-shear coupling. Compos Sci Technol 170:15–24
Acknowledgements
DF and JT gratefully acknowledge the support by the U.S. National Science Foundation (NSF) CAREER Award CMMI-2143662. SR gratefully acknowledges support from the U.S. Department of Energy (DOE), Office of Energy Efficiency and Renewable Energy (EERE) under the Building Technology Office (BTO) Award Number DE-EE0008675. CZ acknowledges the support by the NSF under Award CMMI-1846863. DF and JT also thank the Center for Computational Research (http://www.buffalo.edu/ccr.html) at University at Buffalo for providing HPC resources that have contributed to the research results reported here. The authors are grateful to the referees for their constructive inputs.
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Jingye Tan and Pedram Maleki have contributed equally to this work.
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Tan, J., Maleki, P., An, L. et al. A predictive multiphase model of silica aerogels for building envelope insulations. Comput Mech 69, 1457–1479 (2022). https://doi.org/10.1007/s00466-022-02150-5
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DOI: https://doi.org/10.1007/s00466-022-02150-5