Abstract
Background
Inverse indentation analysis (IIA) optimizes the adjustable parameters in a chosen constitutive description of crystal plasticity until the load–depth response and the residual surface topography match between real and simulated nanoindentation into one (or multiple) grains. Based on synthetic data, past work demonstrated that initial critical resolved shear stress (CRSS) values of hexagonal crystals could be extracted with good reproducibility from indenting a single strategically chosen crystal orientation.
Objective
The goal of the present contribution is to more deeply assess the IIA method using measured (instead of synthetic) topography and load–depth data sets that were acquired for three different Ti alloys at ambient and elevated temperature, and fitted based on a size-independent phenomenological power-law constitutive description of crystal plasticity.
Methods
The uncertainties in measuring surface topography and load–depth response and the uncertainties resulting from choices made in the setup of the finite element indentation simulation are quantified and linked to the reliability of the ultimately identified CRSS values.
Results
Surface topography uncertainties largely outweigh those of the load–depth response. Optimization can be accelerated by upscaling of shallower indentation simulations but only to a limited degree, i.e., to about an upscaling factor of 2 to 3. The physical interpretation of identified CRSS values needs careful consideration of the effect of limited indentation depth.
Conclusions
The present work demonstrates that reliable identification of CRSS values is possible when the combined relative deviations in topography and load–depth response inherent in the actual indentation experiment and in the practical constraints of the corresponding simulations stay below around 20 %. Consequently, the applicability of the IIA method requires pre-assessment of the uncertainties outlined in this work to determine the feasibility of extracting constitutive parameters and their expected validity.
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Data Availability
The raw data (measured load–depth responses and surface topographies as well as the simulation setups) required to reproduce these findings are available to download from https://doi.org/10.17632/b3g4mkm96v.1. The overall optimization framework is hosted on GitHub at https://github.com/zhuowenzhao/Optimizer. The processed data required to reproduce these findings cannot be shared at this time due to time limitations.
Notes
Basal slip on {0001} \(\langle 1\;\bar 2\;1\;0 \rangle\), prism slip on \(\{1\;0\;\bar1\;0\}\; \langle 1\;\bar 2\;1\;0 \rangle\) , pyramidal \(\langle {a}\rangle\) slip on \(\{1\;0\;\bar1\;1\}\; \langle 1\;\bar 2\;1\;0 \rangle\) , and pyramidal \(\langle {c+a}\rangle\) slip on \(\{1\;0\;\bar1\;1\}\; \langle 2\;\bar 1\;\bar 1\;3 \rangle\)
No elevated-temperature indentation was performed for Ti-3Al-2.5V.
Because mechanical twinning, consistent with prior work (e.g. [12]), has not been observed on the surface surrounding an indent, it is not considered as part of the constitutive description.
With regard to the fixed values of hardening slope, two aspects are worth considering. First, the numerical cost of IIA is scaling unfavorably with the dimension of the parameter space, such that a low-dimensional space becomes almost imperative. Second, given above constraint, optimization should be focused on the most sensitive parameters in the chosen constitutive description, which are the initial CRSS values.
In our study, we realized that, in contrast to the pile-ups, the indentation valley exhibits a marked time-dependent reverse deformation. Since the chosen constitutive description does not include kinematic hardening, which appears to be responsible for the observed effect, we excluded the part of the surface topography that falls beneath the indenter tip to avoid the associated systematic (and non-negligible) topography deviations.
The general terminology of “a” and “b” was deliberately chosen, since a pair is not always made up of an experimental reference and a simulated prediction. For instance, Fig. 3(a) illustrates the deviation between a directly simulated and an extrapolated simulated outcome, hence, “a” and “b” would both be classified as “simulation”.
In this work, two indentations closely agree if their crystallographic indentation directions differ by no more than 7°. We note that for seven out of the 12 pairs that were considered, the axis misorientation was actually less than 2°. To account for the different in-plane orientations of the paired grains, one surface topography was rotated about the surface normal to consistently align with the other (see [24, 25] for details).
This concern disappears with finer mesh resolutions, but the chosen mesh used in this study is coarse to increase the affordability.
Since repeated measurements in the same grain were only done in CP-Ti (solid curves), the likely errors for Ti-3Al-2.5V and Ti-6Al-4V need to be estimated from pairs of similar grains with closely agreeing indentation directions (dashed curves). Specifically, in Fig. 2(c), the (missing) solid green and blue populations are estimated to be a factor of 2 below the respective dashed ones (reflecting the ratio observed for red and orange dashed to solid), while solid purple is estimated to be a factor of 2.3 below the dashed blue population (additionally considering the red to orange shift). In Fig. 2(d), all solid populations are assumed to be equivalent to the dashed ones because no systematic difference is observed for red and orange; the missing purple population is estimated as the blue population scaled by a factor of 3.3 (based on the red to orange shift).
The stress exponent is inversely related to strain rate sensitivity
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Acknowledgements
Funding from the U.S. National Science Foundation (grant DMR-1411102) is gratefully acknowledged. TRB, JL, and ZZ acknowledge additional support via the Talent Attraction program of the Comunidad de Madrid (reference 2016-T3/IND-1600) that supported work done at IMDEA Materials Institute in Madrid. ZZ would like to thank Dr. Satyapriya Gupta for his help in setting up the ABAQUS indentation simulations and Dr. Aritra Chakraborty for providing the programmatic framework on which the optimizations were built. The authors appreciate the insightful comments made by the reviewers that helped improve the manuscript and inspired discussion about the concerns regarding the indentation size effect in the inverse indentation analysis.
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Appendices
Simulation Framework and Constitutive Model
Deformation Kinematics
The current model is formulated within a finite-strain framework and uses the multiplicative decomposition [23] of the total deformation gradient
into an elastic deformation gradient \(\mathbf {F}_\text {e}\) and a plastic deformation gradient \(\mathbf {F}_\text {p}\). The plastic deformation rate
is related to plastic velocity gradient \(\mathbf {L}_\text {p}\), which, in turn, is additively composed from slip rates on individual slip systems,
where the unit vectors \(\mathbf {s}^\alpha\) and \(\mathbf {n}^\alpha\) are the slip direction and slip plane normal for slip system \(\alpha = 1,2,3,\ldots ,N\). The shear stress resolved on a particular slip system \(\alpha\) follows from Hooke’s law as
Phenomenological Power-Law Description
The shear rate
is governed by the ratio between the corresponding resolved shear stress \(\tau ^{\alpha }\) and slip resistance \(\xi ^{\alpha }\) raised to a power \(n\) (stress exponent). The slip resistance
evolves from an initial value \(\xi _0^{\alpha }\) asymptotically with shear accumulating on all slip systems, where \(h_0\) is a prefactor, \(a\) a fitting parameter, \(q^{\alpha \beta }\) the cross-hardening matrix, and \(\xi _\infty ^{\beta }\) reflects the asymptotic slip resistance of the family containing slip system \(\beta\).
Experimental Data
Figures 7 and 8 collect the surface topography and load–depth response, respectively, of all indentations separated by material and indentation temperature.
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Zhao, Z., Ruiz, M.R., Lu, J. et al. Quantifying the Uncertainty of Critical Resolved Shear Stress Values Derived from Nano-Indentation in Hexagonal Ti Alloys. Exp Mech 62, 731–743 (2022). https://doi.org/10.1007/s11340-021-00813-7
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DOI: https://doi.org/10.1007/s11340-021-00813-7