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Matt I J Probert

Showing results (1-10 of 9) with videos related to

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The Journal of Chemical Physics|October 10, 2024
An ab initio approach to the HugoniotJacob S Wilkins, Matt I J Probert
The Journal of Physical Chemistry. A|May 6, 2022
Systematic Comparison of Genetic Algorithm and Basin Hopping Approaches to the Global Optimization of Si(111) Surface ReconstructionsMaximilian N Bauer, Matt I J Probert, Chiara Panosetti
Nucleic Acids Research|January 14, 2020
The emergence of sequence-dependent structural motifs in stretched, torsionally constrained DNAJack W Shepherd, Robert J Greenall, Matt I J Probert, et al.
Journal of Chemical Theory and Computation|February 16, 2018
DL_MG: A Parallel Multigrid Poisson and Poisson-Boltzmann Solver for Electronic Structure Calculations in Vacuum and SolutionJames C Womack, Lucian Anton, Jacek Dziedzic, et al.
Philosophical Transactions. Series A, Mathematical, Physical, and Engineering Sciences|February 12, 2014
Density functional theory in the solid statePhilip J Hasnip, Keith Refson, Matt I J Probert, et al.
Nanoscale|July 14, 2017
Atomistic dynamics of sulfur-deficient high-symmetry grain boundaries in molybdenum disulfideJinhua Hong, Yanlei Wang, Anle Wang, et al.
The Journal of Chemical Physics|August 3, 2019
Off-the-shelf DFT-DISPersion methods: Are they now "on-trend" for organic molecular crystals?Dawn Geatches, Ian Rosbottom, Richard L Marchese Robinson, et al.
The Journal of Chemical Physics|July 27, 2023
Machine-learned acceleration for molecular dynamics in CASTEPTamás K Stenczel, Zakariya El-Machachi, Guoda Liepuoniute, et al.
Science (New York, N.Y.)|March 26, 2016
Reproducibility in density functional theory calculations of solidsKurt Lejaeghere, Gustav Bihlmayer, Torbjörn Björkman, et al.
Pageof 1

Showing results (1-10 of 9) with videos related to

Sort By:
Pageof 1
The Journal of Chemical Physics|October 10, 2024
An ab initio approach to the HugoniotJacob S Wilkins, Matt I J Probert
The Journal of Physical Chemistry. A|May 6, 2022
Systematic Comparison of Genetic Algorithm and Basin Hopping Approaches to the Global Optimization of Si(111) Surface ReconstructionsMaximilian N Bauer, Matt I J Probert, Chiara Panosetti
Nucleic Acids Research|January 14, 2020
The emergence of sequence-dependent structural motifs in stretched, torsionally constrained DNAJack W Shepherd, Robert J Greenall, Matt I J Probert, et al.
Journal of Chemical Theory and Computation|February 16, 2018
DL_MG: A Parallel Multigrid Poisson and Poisson-Boltzmann Solver for Electronic Structure Calculations in Vacuum and SolutionJames C Womack, Lucian Anton, Jacek Dziedzic, et al.
Philosophical Transactions. Series A, Mathematical, Physical, and Engineering Sciences|February 12, 2014
Density functional theory in the solid statePhilip J Hasnip, Keith Refson, Matt I J Probert, et al.
Nanoscale|July 14, 2017
Atomistic dynamics of sulfur-deficient high-symmetry grain boundaries in molybdenum disulfideJinhua Hong, Yanlei Wang, Anle Wang, et al.
The Journal of Chemical Physics|August 3, 2019
Off-the-shelf DFT-DISPersion methods: Are they now "on-trend" for organic molecular crystals?Dawn Geatches, Ian Rosbottom, Richard L Marchese Robinson, et al.
The Journal of Chemical Physics|July 27, 2023
Machine-learned acceleration for molecular dynamics in CASTEPTamás K Stenczel, Zakariya El-Machachi, Guoda Liepuoniute, et al.
Science (New York, N.Y.)|March 26, 2016
Reproducibility in density functional theory calculations of solidsKurt Lejaeghere, Gustav Bihlmayer, Torbjörn Björkman, et al.
Pageof 1