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Austenite Engineering & Materials Science

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Projects 2008 2019

Research Output 2002 2017

A force-matching Stillinger-Weber potential for MoS2: Parameterization and Fisher information theory based sensitivity analysis

Wen, M., Shirodkar, S. N., Plecháč, P., Kaxiras, E., Elliott, R. S. & Tadmor, E. B. Dec 28 2017 In : Journal of Applied Physics. 122, 24, 244301

Research output: Contribution to journalArticle

Molybdenum compounds
molybdenum compounds
Fisher information matrix
Fisher information
Uncertainty analysis
2 Citations

A KIM-compliant potfit for fitting sloppy interatomic potentials: Application to the EDIP model for silicon

Wen, M., Li, J., Brommer, P., Elliott, R. S., Sethna, J. P. & Tadmor, E. B. Jan 1 2017 In : Modelling and Simulation in Materials Science and Engineering. 25, 1, 014001

Research output: Contribution to journalArticle

Interatomic Potential
2 Citations

Hierarchical honeycomb material design and optimization: Beyond linearized behavior

Combescure, C. & Elliott, R. S. Jun 1 2017 In : International Journal of Solids and Structures. 115-116, p. 161-169 9 p.

Research output: Contribution to journalArticle

Material Design
Critical Load
Materials properties
6 Citations

Post-bifurcation and stability of a finitely strained hexagonal honeycomb subjected to equi-biaxial in-plane loading

Combescure, C., Henry, P. & Elliott, R. S. Jun 15 2016 In : International Journal of Solids and Structures. 88-89, p. 296-318 23 p.

Research output: Contribution to journalArticle

Bloch Waves
9 Citations

A spectral scheme for Kohn-Sham density functional theory of clusters

Banerjee, A. S., Elliott, R. S. & James, R. D. Apr 5 2015 In : Journal of Computational Physics. 287, p. 226-253 28 p.

Research output: Contribution to journalArticle

Density functional theory
density functional theory
spectral methods
Electronic structure