Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty...

40
Uncertainty Quantification: What is it and Why it is Important to Test, Evaluation, and Modeling and Simulation in Defense and Aerospace Peter Qian, Professor in Statistics, University of Wisconsin-Madison, Chief Scientist, SmartUQ Dr. Mark Andrews, UQ Technology Steward, SmartUQ

Transcript of Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty...

Page 1: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Uncertainty Quantification: What is it and Why it is Important to Test, Evaluation,

and Modeling and Simulation in Defense and Aerospace

Peter Qian, Professor in Statistics, University of Wisconsin-Madison, Chief Scientist, SmartUQ

Dr. Mark Andrews, UQ Technology Steward, SmartUQ

Page 2: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Introduction to Uncertainty Quantification (UQ)– Historical Perspective

– Definitions, Terminology and Value of UQ

Industry Challenges

Overview of Methods

Current UQ Technical Bottlenecks

Selected UQ Methods • DOE for Multiple Data Sources

• UQ for Multi-Source Simulations

• Grounding Models in Reality using Statistical Calibration

Outline

2

Page 3: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Before CAE CAE

Historical Overview

However, CAE has new rules . . . have I built the model right? . . . (model verification)have I built the right model?. . . (model validation)have I accounted for real-life uncertainties?

Design verification by virtual testing of computer models

Design verification by prototype testingHands-on learning, tribal knowledge

3

Page 4: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

UQ is Rapidly Growing Field With Broad Applications in Aerospace and Defense

62

2789

5667

12572

26095

32634

1959-OLDER 1960-1979 1980-1990 1991-2000 2001-2010 2011-2016

Nu

mb

er

of

Pu

bli

ca

tio

ns

Year Range

Science Direct Search for Publications with "Uncertainty" in Title, Abstract or Keyword

SIAM/ASA Journal on Uncertainty

Quantification (2013)

ASME Journal of Verification,

Validation and Uncertainty

Quantification (2016)

NAFEMS Stochastic

Working Group (2000)

SAE G-11 Probabilistic

Methods Committee (1998)

AIAA Non-Deterministic Approaches

Conference Technical Committee (1999)

4

Page 5: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Materials: Uncertainties in Powder Metallurgy process

Environment and Product Operators

As Designed Strength

Manufacturing: Uncertainties in heat treatment

Systems Integration: Component failure modes

StrengthDistribution

Uncertainty Quantification (UQ) is the science of identifying, characterizing and managing those factors in the analyses of complex systems, physical tests or simulations that impact the accuracy of the results

UQ puts the ‘error bars’ on the simulation resultsMore generally, UQ can put ‘error bars’ on nearly any data or system

5

Page 6: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

UQ is a Probabilistic Approach

Load Strength

Deterministic

Strength/Load Design FactorAcceptable?

Deterministic (Design Factor) Approach

• Simple, efficient & easy to understand

• Design Factors do not do not quantify the risk of failure or specify how close the value is to being unacceptable

• Deterministic Approach typically do not include knowing parameter sensitivities

MPa

Freq

uen

cy

Load Strength

Probability of FailureAcceptable?

ProbabilisticProbabilistic Approach

• Iteration of the Deterministic Approach

• Quantifies the risk of failure and specifies how close the value is to being unacceptable

• Provides parameter sensitivity analysis that tells you which model parameters have the greatest influence the simulation response

MPa

Freq

uen

cy

6

Page 7: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

There are Many Sources of Uncertainty

Uncertain System Inputs

• Any system input including initial conditions, boundary conditions, and transient forcing functions

Model Form and Parameter Uncertainty

• The inherent inaccuracy of the model and all assumptions made about the modeling parameters

Computational and Numerical Uncertainty

• The uncertainties resulting from the simplifications and approximations necessary to solve the system models.

Uncertainty in Physical Testing

• The uncertainty resulting from experimental error, physical variation, measurement uncertainty, and test set up.

For more information see: https://www.smartuq.com/resources/uncertainty-quantification/

7

Page 8: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Uncertain System Inputs

• Unknown Parameter Values: • Hard to measure system input parameters with fixed, but unknown, values.

• These are often an epistemic uncertainty.

• Examples include: as built material properties, operating environment, and actual loading profiles.

• Variable Parameter Values: • System inputs which are not fixed and may be inherently uncertain.

• Often subject to a known, or at least measurable, probability distribution.

• Examples include: Manufactured part geometry, fuel composition, and exact time of ignition.

0

2

4

6

8

10

0 0.3 0.6 0.9 1.2 1.5 1.8 2.1 2.4 2.7 3 3.3 3.6 3.9 4.2 4.5 4.8

An

nu

al C

ycle

s (

x10

00

)

Operating Load

Operator Variability

Use Case

In this graph: The eventual operator is an unknown parameter while the use profile for each operator is a variable parameter.

8

Page 9: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Model Form Uncertainty

• All models are approximations of reality.

• Modeling uncertainty is the result of errors, assumptions, and approximations made when choosing the model.

• Can be broken into: • Model form uncertainty, i.e. uncertainty about the models ability to capture

the relevant system behaviors.

• Parameter uncertainty, i.e. uncertainty about parameters within the model.

Model Form and Parameter Uncertainty

-0.2

-0.1

0

0.1

0.2

0.3

0 0.4 0.8 1.2 1.6 2 2.4 2.8 3.2 3.6 4 4.4 4.8Dis

crep

ency

Load

Discrepency/Bias Function

Modeling Accuracy• Handling these types of uncertainty:

• Requires ‘true’ data from the system being modeled.

• Model form uncertainty is best treated with statistical calibration techniques capable of building a discrepancy model.

• Parameter uncertainty may be handled with other unknown or variable system inputs.

9

Page 10: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Computational and Numerical Uncertainty

• Most numerical models including FEA, CFD, and iteratively solved 1D models require simplification or approximation to solve.

• Thus the mathematical description might be perfect but factors such as truncation and convergence error may still introduce uncertainty.

• This will vary between different numerical solvers and different solver settings.

• Handling these types of uncertainty:

• Continuous solver settings may be treated as additional system input variables.

• i.e. the solver tolerance may be modelled as a continuous input.

• Solver type or categorical solver settings may be modelled as a discrete system inputs.

• i.e. similar combustion models may be solved in ANSYS or Converge and different levels of combustion chemistry fidelity may be used in either.

Computational and Numerical Error

10

Page 11: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Uncertainty in Physical Testing

• Arises from uncontrolled or unknown inputs, measurement errors, aleatoric phenomena, and limitations in the design and implementation of tests.

• Results in noisy experimental data.Physical Testing Uncertainty

0

0.2

0.4

0.6

0.8

1

1.2

1.4

1.6

0 0.5 1 1.5 2 2.5 3Ti

me

to F

ailu

rePart Load

Time to Failure

Materials and Manufacturing

• Handling this type of uncertainty:• Inverse analysis can be used to

determine the input probability distributions.

• Distributions or empirical measurements can be handled as additional variable system input variables.

11

Page 12: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

UQ Enables a One-Time Process for Product Development

• Reduce Costs Driven by Variability

– Prevent unnecessary design iterations

– Shorter development times; fewer tests / prototypes

• Maximize Product Reliability and Durability

– Reduce part-to-part variability increases product life

– Fixing problems in design is cheaper than in the field

• Ensure Simulation Results are Credible and Realistic

– Critical for model validation and what-if scenarios

– Essential for understanding risks for decision making

Build

Test

Design

Design Build Test

12

Page 13: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Major DOD Initiative for Model Verification and Validation

Director of Operational Test and Evaluation Office of the Secretary of Defense, Michael Gilmore

The V&V [Verification and Validation] allows engineers to make fewer model runs and have credible information to support future modeling and simulation evaluations

“Our intent is to make this [Uncertainty Quantification] the default approach that ARDEC uses for all the modeling and simulation work that we do here”, Douglas Ray (Mathematical Statistician Technical Lead at QE&SA Reliability Management Branch of US Army RDECOM ARDEC).

From ‘The Picatinny Voice’ Vol 29, No 17, August 19, 2016. http://www.pica.army.mil/Pictinny/voice/voice/pdfand the DOE Memorandum for Commanding General, Army Test and Evaluation Command, March 14, 2016http://www.dote.osd.mil/pub/policies/2016/20140314_Guidance_on_Valid_of_Mod_Sim_used_in_OT_and_LF_Assess_(10601).pdf

13

Page 14: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Industry Challenges

14

Page 15: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Ohio Aerospace Institute (OAI) and PACE

15

PACE goals

• Establish probabilistic design and validation methodologies as a routinely accepted tool by the aviation, propulsion and power generation industries

• Address development costs, verification and risk analysis in gas turbine engine design

• Leverage resources and technical expertise of its members for the accomplishment of selected research activities

Membership: Aero Engine OEM’s.

Ohio Aerospace Institute (OAI) is an organization under contract with the Air force Research Laboratory (AFRL) to create and manage the Probabilistic Analysis Consortium for Engines (PACE) consortium.

Page 16: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

PACE Identified Research Interests

16

Method Challenges:

• Robust computational grid perturbation (from parametric CAD)

• Simulation time

• Stochastic input definition

• Model uncertainty quantification

• Validation data and strategy

Application Area Challenges:

• Secondary flow system temperatures and pressures

• Steady aero performance

• Unsteady aero loading

• Internal turbine cooling

• Depot Inspection Data analysis

• NSMS, TWE, etc., Uncertainty Quantification

Page 17: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

UQ for Additive Manufacturing• Additive Manufacturing (AM) is an additive process of

constructing an object rather than the subtractive process of traditional manufacturing.

• AM is used throughout the aerospace community to develop prototypes, produce components with complex, aerodynamic geometries and to fix parts made by conventional manufacturing.

• Sources of AM Uncertainty for Selective Laser Sintering

• Variations in laser power, scan speed, hatch spacing, layer thickness, scan pattern

• Variations in powder morphology, melt and cooling temperatures

• Impact from process uncertainties

• Variations in microstructure, mechanical properties of yield and ultimate strengths and elastic modulus

• Mechanical properties are anisotropic

• Deformed geometry from residual stresses

• Role of UQ in AM

• Prediction of material properties and component performance from AM process parameters

Serve delaminations in Oak Ridge National Laboratory's development of a solely 3D printed car were caused by micro-level uncertainties in the powder. Photo Credit Oak Ridge National Laboratory “Computational Simulations for Additive Manufacturing”.

AM Institutes and Consortiums• National Additive Manufacturing Innovation

Institute (NAMII), manufacturing.gov• Additive Manufacturing Consortium (AMC),

Edison Welding Institute• Consortium for Additive Manufacturing

Materials (CAMM), NIST Office of Advanced Manufacturing

17

Page 18: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

UQ for Digital Twins

• Digital Twins serves two main purposes:

• The object can be built and tested in a virtual environment instead of physical prototypes.

• With real-time data, it can optimize the life-span of the object reducing maintenance and downtime costs.

• The Role of UQ with Digital Twins

• Provide margins on predictions and identify uncertainties that cannot be modeled

• Determine the discrepancy between the physical object’s readings and the digital twin’s. A significant difference could be a sign for needed maintenance.

• Use sensitivity analysis to determine the significant parameters and which can be reduced. This will reduce the computational cost of future analysis.

Consortiums• Industrial Internet Consortium

established by AT&T, Cisco Systems, General Electric, Intel and IBM

• Industrie 4.0, Gemany• International Consortium of

Advanced Manufacturing Research, Kissimmee FL

“A Digital Twin is an integrated multiphysics, multiscale, probabilistic simulation of an as-built vehicle or system that uses the best available physical models, sensor updates, fleet history, etc., to mirror the life of its corresponding flying twin.”

- “The Digital Twin Paradigm for Future NASA and U.S. Air Force Vehicles”, E. H. Glaessgen, D.S. Stargel, AIAA 53rd Structures, Structural Dynamics, and Materials Conference: Special Session on the Digital Twin, 2012

Photo Credit: Digitally Cognizant Blog

18

Page 19: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Overview of Methods

19

Page 20: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

UQ Has Many Process Components

20

Stat

isti

csHigh-dimensionalIn

terp

ola

tor

Mis

sin

g D

ata

Parallel ComputingNonparametrics

Co

mp

ress

ed S

ensi

ng

Latin Hypercube Design

Design of Experiments

Stochastic Optimization

Active Learning

Deep Learning

Mac

hin

e Le

arn

ing

Karmen Filter

Emulation

Bayesian Methods Inverse Problem

Multi-level Monte Carlo

Sparse Grids

Poly

no

mia

l Ch

aos

Gaussian Process

Data Fusion

Spatial-temporal Data

Dimension Reduction

Seq

uen

tial

Des

ign

L1-M

inim

izat

ion

GPU

Page 21: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Current UQ Technology Bottlenecks

21

• Conducting system level UQ with high-dimensional inputs

• UQ with fusion of simulation and physical data

• UQ with data from multiple simulation sources

• UQ with missing data

• UQ with complex data (e.g., transient and spatial responses)

• UQ with complex geometry

• UQ for design, manufacturing and operation (IoT)

Page 22: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Selected UQ Methods

22

Page 23: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Samurai Sudoku-Based Space-Filling Designs for Data Pooling

23

Page 24: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

A Samurai Sudoku-Based Space-Filling Design

• The points can be divided into five overlapped slices.

• Red is the connecting slice and the same symbol denotes the same slice.

• Points in each slice is a Sudoku-based space-filling designs with 16 points.

24

Page 25: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

The Connecting Slice of 16 Points

25

Page 26: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

One Overlapping of Four Points

26

Page 27: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

UQ Applications for Samurai Sudoku

• Quantify and adjust the differences between multiple simulation models

• Make inference for every single source

• Perform combined analysis for all sources

• Cross-validation

• Parallel Computing

27

Page 28: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Multi-Source UQ

• Build statistical emulators using continuous and categorical data types

• Examples • Combine numerical solutions

when solving the same model using different software routines

• Continuous and discrete inputs.

• Advantage: Combined emulator will likely have improved accuracy over separate emulators

• Differences and uncertainty due to solvers used can be quantified

28

Categorical Inputs

...Solver-2

Solver-n

Solver-1

Continuous Inputs

Combined Emulator

Output Predictions

...

Reference: Qian, Wu and Wu (2008)

Page 29: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Ex. 3: Mixed Data Emulation for Multi-Source Application

Collaboration with Caterpillar’s Virtual

Product Development team

Two inputs: UTS and Elastic Modulus at

discrete FE nodal locations

One output: Mean Stress

Analysis Procedure:

• Built emulators from simulation data

• Conduct parameter sensitivity analysis

• Propagate uncertainties

29

Page 30: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Ex. 3: Mixed Data Emulation for Multi-Source Application

Leave One Out Prediction

1.000

0.978

0.957

0.935

0.913

0.891

0.870

0.848

0.826

No

rmal

ized

Mea

n S

tres

s

0.82

6

0.84

8

0.87

0

0.89

1

0.91

3

0.93

5

0.95

7

0.97

8

1.00

0

The Individual Emulator has difficulty fitting the data due to a lack of sufficient

information

1.109

1.087

1.065

1.043

1.022

1.000

0.978

0.957

0.935

0.913

0.891

0.870

0.848

0.826

No

rmal

ized

Mea

n S

tres

s

0.8

26

0.8

48

0.8

70

0.8

91

0.9

13

0.9

35

0.9

57

0.9

78

1.0

00

1.0

22

1.0

43

1.0

65

1.0

87

1.1

09

Leave One Out Prediction

The Combined Emulator shows significant improvement due to sharing of

information between discrete input levels.

Individual Emulator Combined Emulator

30

Method 1: Method 2:

Page 31: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Ex. 3: Propagating Uncertainties from Mixed Data Emulation for Multi-Source Application

31

Response surface suggests bimodal behavior for Modulus

Page 32: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Grounding Models in Reality Using Statistical Calibration

32

Page 33: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Making Simulations More Realistic• Test data are used to calibrate specific parameters in a model to improve fit

between the model and data.

• Typically, calibration parameters that cannot be directly measured in a physical experiment are used.

• Directly measurable inputs are fed into the simulation and the calibration parameters are adjusted.

• Calibration ensures models are physically grounded and increases accuracy.

Recorded Variables

Calibration Parameters

Recorded Variables

Indirectly Observable Parameters

Experiment

Model

Statistical Calibration

Fitted Calibration Parameters

Real World System

System Model

Improved Predictive

ModelDiscrepancy Model

33

Page 34: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Bayesian Calibration

• Use of Expert opinions and beliefs through prior distribution.

• A framework to estimate calibration parameters and discrepancy, simultaneously.

• Estimate calibration parameters as distributions.

• Allow probabilistic predictions to make quantification of uncertainties from multiple sources (input, model, measurement) easier.

• Reference: Kennedy and O’Hagan (2001)

34

Page 35: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Example: Large Deflections of Cantilevered Beam

• Numerical model of a rectangular steel beam subject to a uniformly distributed load, w, and a point load, F, applied at the beam’s free end.

• Statistical Calibration was used to match the Young’s modulus, E, of the beam to an experimental data set which varied the point force, F, and recorded the vertical displacement of the beam’s free end, δy.

• Calibration was performed using 20 simulation runs and 7 physical test points

35

Page 36: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Beam Deflection Calibration Results

0.05

0.1

0.15

0.2

0.25

0.3

0 0.2 0.4 0.6

Tip

Dis

pla

cem

ent

[m

]

Applied Force [N]

Uncalibrated Simulation vs. Physical Data

Experimental

0.05

0.1

0.15

0.2

0.25

0.3

0 0.2 0.4 0.6

Tip

Dis

pla

cem

ent

[m

]

Applied Force [N]

Uncalibrated Simulation vs. Physical Data

Experimental

SmartUQ Cal. (194.15GPa)

0.05

0.1

0.15

0.2

0.25

0.3

0 0.2 0.4 0.6

Tip

Dis

pla

cem

ent

[m

]

Applied Force [N]

Uncalibrated Simulation vs. Physical Data

• The results from the uncalibrated beam bending model do not fit the physical data well.

• Calibrate the material’s Elastic Modulus.

• The calibrated results match the experimental data very well.

36

Page 37: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Results: Model Discrepancy

-0.003

-0.002

-0.001

0

0.001

0.002

0.003

0.00 0.10 0.20 0.30 0.40 0.50 0.60

Dis

cre

pe

ncy

[m

]

Applied Force [N]

Discrepancy with Experimental Data

True Discrepency

-0.003

-0.002

-0.001

0

0.001

0.002

0.003

0.00 0.10 0.20 0.30 0.40 0.50 0.60

Dis

cre

pe

ncy

[m

]

Applied Force [N]

Discrepancy with Experimental Data

True Discrepency

EstimatedDiscrepency

• Calibration yields an estimate of the Young’s Modulus: E = 194.15 [GPa]

• There are two curves plotted

– true discrepancy from test data and simulation

– estimated discrepancy using statistical calibration

• Discrepancy plots give us more than an R2 value between two curves

• Indicate how both model and data uncertainties impact the simulation results

over predictsunder predicts

37

Page 38: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

A Chemical Reaction Model

• A Kinetics of the chemical reaction is built for 𝑆𝑖𝐻4 → 𝑆𝑖 + 2𝐻2.

• 𝑦 𝑡 = 𝑦0exp −𝑢𝑡 where𝑦 𝑡 = concentration of 𝑆𝑖𝐻4 as a function of time𝑦0 0 = initial concentration𝑢 is an unknown rate that is specific to this chemical reaction.

• In actual experiments:𝑦 𝑡 = (𝑦0−𝑐)exp(−𝑢𝑡) + 𝑐 + 𝜀, Where c = residual concentration of 𝑐 units is left unreactedand 𝜀 is the measurement error assumed to follow N(0,0.32).

• Initial conditions 𝑦0 = 5c = 1.5, 𝑢 = 1.7, unknown.

38

Page 39: Uncertainty Quantification: What is it and Why it is ... · Introduction to Uncertainty Quantification (UQ) –Historical Perspective –Definitions, Terminology and Value of UQ Industry

Results: Bayesian Calibration

Y

Dis

crep

ancy

t

Den

sity

u39