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Journal of Chemical Theory and Computation|August 14, 2018
Ab Initio Finite Temperature Auxiliary Field Quantum Monte CarloYuan Liu, Minsik Cho, Brenda RubensteinJournal of Chemical Theory and Computation|May 28, 2020
Unveiling the Finite Temperature Physics of Hydrogen Chains via Auxiliary Field Quantum Monte CarloYuan Liu, Tong Shen, Hang Zhang, et al.Journal of Physics. Condensed Matter : an Institute of Physics Journal|May 6, 2020
First principles calculations of the electric field gradient tensors of Ba2NaOsO6, a Mott insulator with strong spin orbit couplingRong Cong, Ravindra Nanguneri, Brenda Rubenstein, et al.Faraday Discussions|September 16, 2024
Gaussian processes for finite size extrapolation of many-body simulationsEdgar Josué Landinez Borda, Kenneth O Berard, Annette Lopez, et al.ACS Nano|December 20, 2023
Enabling Pd Catalytic Selectivity via Engineering Intermetallic Core@Shell StructureMengqi Shen, Amir Afshar, Nathan Sinai, et al.Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|February 29, 2024
Self-Consistent Convolutional Density Functional Approximations: Application to Adsorption at Metal SurfacesSushree Jagriti Sahoo, Qimen Xu, Xiangyun Lei, et al.The Journal of Chemical Physics|January 9, 2022
A combined first principles study of the structural, magnetic, and phonon properties of monolayer CrI3Daniel Staros, Guoxiang Hu, Juha Tiihonen, et al.Biorxiv : the Preprint Server for Biology|July 16, 2025
Lubricin's Mucin Domain Has Strong Polyproline Type-II Helical CharacterBibo 'Noah' Feng, Ava J Marks, Faith Kim, et al.Plos Computational Biology|May 2, 2022
A topological data analytic approach for discovering biophysical signatures in protein dynamicsWai Shing Tang, Gabriel Monteiro da Silva, Henry Kirveslahti, et al.Proceedings of the National Academy of Sciences of the United States of America|October 29, 2024
Is stochastic thermodynamics the key to understanding the energy costs of computation?David H Wolpert, Jan Korbel, Christopher W Lynn, et al.Pageof 2