학술논문

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발행년	- (예 : 2010-2015)

Type Label Framework for Bonded Force Fields in LAMMPS

Academic Journal

Gissinger, J.R.; Nikiforov, I.; Afshar, Y.; Waters, B.; Choi, M.-K.; Karls, D.S.; Tadmor, E.B.; Stukowski, A.; Im, W.; Heinz, H.; Kohlmeyer, A.

In: Journal of Physical Chemistry B. (Journal of Physical Chemistry B, 4 April 2024, 128(13):3282-3297)

Full Text (ACS) Web of Science JCR 저널정보 Scopus Find it@PNU

Automated determination of grain boundary energy and potential-dependence using the OpenKIM framework

Academic Journal

Waters, B.; Karls, D.S.; Nikiforov, I.; Elliott, R.S.; Tadmor, E.B.; Runnels, B.

In: Computational Materials Science. (Computational Materials Science, 5 March 2023, 220)

Full Text (ScienceDirect) Web of Science JCR 저널정보 Scopus Find it@PNU

Bayesian, frequentist, and information geometric approaches to parametric uncertainty quantification of classical empirical interatomic potentials

Academic Journal

Kurniawan, Y.; Petrie, C.L.; Williams, K.J.; Transtrum, M.K.; Tadmor, E.B.; Elliott, R.S.; Karls, D.S.; Wen, M.

In: Journal of Chemical Physics. (Journal of Chemical Physics, 7 June 2022, 156(21))

Full Text (AIP) Web of Science JCR 저널정보 Scopus Find it@PNU

The OpenKIM processing pipeline: A cloud-based automatic material property computation engine

Academic Journal

Karls, D.S.; Elliott, R.S.; Tadmor, E.B.; Bierbaum, M.; Alemi, A.A.; Sethna, J.P.

In: Journal of Chemical Physics. (Journal of Chemical Physics, 14 August 2020, 153(6))

Full Text (AIP) Web of Science JCR 저널정보 Scopus Find it@PNU

Injecting Domain Knowledge from Empirical Interatomic Potentials to Neural Networks for Predicting Material Properties

Conference

Shui, Z.; Karls, D.S.; Nikiforov, I.A.; Tadmor, E.B.; Karypis, G.; Wen, M.

In: Advances in Neural Information Processing Systems, Advances in Neural Information Processing Systems 35 - 36th Conference on Neural Information Processing Systems, NeurIPS 2022. (Advances in Neural Information Processing Systems, 2022, 35)

Scopus Find it@PNU

HPC Extensions to the OpenKIM Processing Pipeline

Conference

Karls, D.S.; Waters, B.A.; Elliott, R.S.; Tadmor, E.B.; Clark, S.M.

In: Proceedings - 2022 IEEE 18th International Conference on e-Science, eScience 2022, Proceedings - 2022 IEEE 18th International Conference on e-Science, eScience 2022. (Proceedings - 2022 IEEE 18th International Conference on e-Science, eScience 2022, 2022, :278-283)

Full Text (IEEE) Scopus Find it@PNU

Extending OpenKIM with an Uncertainty Quantification Toolkit for Molecular Modeling

Conference

Kurniawan, Y.; Petrie, C.L.; Transtrum, M.K.; Tadmor, E.B.; Elliott, R.S.; Karls, D.S.; Wen, M.

In: Proceedings - 2022 IEEE 18th International Conference on e-Science, eScience 2022, Proceedings - 2022 IEEE 18th International Conference on e-Science, eScience 2022. (Proceedings - 2022 IEEE 18th International Conference on e-Science, eScience 2022, 2022, :367-377)

Full Text (IEEE) Scopus Find it@PNU

Entropic stabilization of austenite in shape memory alloys

Academic Journal

Elliott, R.S.; Karls, D.S.

In: Journal of the Mechanics and Physics of Solids. (Journal of the Mechanics and Physics of Solids, December 2013, 61(12):2522-2536)

Full Text (ScienceDirect 종량제) Web of Science JCR 저널정보 Scopus Find it@PNU

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