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Journal of Chemical Theory and Computation
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November 19, 2015
A Method for Creating Thermal and Angular Momentum Fluxes in Nonperiodic Simulations
Kelsey M Stocker, J Daniel Gezelter
Journal of Chemical Information and Modeling
|
January 13, 2025
Thermal Transport through CTAB- and MTAB-Functionalized Gold Interfaces Using Molecular Dynamics Simulations
Sydney A Shavalier, J Daniel Gezelter
The Journal of Physical Chemistry. B
|
May 23, 2014
Nitrile vibrations as reporters of field-induced phase transitions in 4-cyano-4'-pentylbiphenyl (5CB)
James M Marr, J Daniel Gezelter
The Journal of Chemical Physics
|
June 24, 2008
Langevin dynamics for rigid bodies of arbitrary shape
Xiuquan Sun, Teng Lin, J Daniel Gezelter
The Journal of Chemical Physics
|
October 3, 2023
A theory of pitch for the hydrodynamic properties of molecules, helices, and achiral swimmers at low Reynolds number
Anderson D S Duraes, J Daniel Gezelter
The Journal of Physical Chemistry. B
|
October 15, 2021
Separation of Enantiomers through Local Vorticity: A Screw Model Mechanism
Anderson D S Duraes, J Daniel Gezelter
The Journal of Chemical Physics
|
October 10, 2014
Real space electrostatics for multipoles. I. Development of methods
Madan Lamichhane, J Daniel Gezelter, Kathie E Newman
The Journal of Chemical Physics
|
December 2, 2020
The role of polarizability in the interfacial thermal conductance at the gold-water interface
Hemanta Bhattarai, Kathie E Newman, J Daniel Gezelter
The Journal of Chemical Physics
|
October 10, 2014
Real space electrostatics for multipoles. II. Comparisons with the Ewald sum
Madan Lamichhane, Kathie E Newman, J Daniel Gezelter
Journal of Chemical Information and Modeling
|
June 11, 2026
Separation of Flexible Enantiomers Using Shear Flow
Minh Nhat Pham, Levi Cherek, J Daniel Gezelter
Page
of 4
Search research articles
Search
Showing results (11-20 of 36) with videos related to
Sort By:
Page
of 4
Journal of Chemical Theory and Computation
|
November 19, 2015
A Method for Creating Thermal and Angular Momentum Fluxes in Nonperiodic Simulations
Kelsey M Stocker, J Daniel Gezelter
Journal of Chemical Information and Modeling
|
January 13, 2025
Thermal Transport through CTAB- and MTAB-Functionalized Gold Interfaces Using Molecular Dynamics Simulations
Sydney A Shavalier, J Daniel Gezelter
The Journal of Physical Chemistry. B
|
May 23, 2014
Nitrile vibrations as reporters of field-induced phase transitions in 4-cyano-4'-pentylbiphenyl (5CB)
James M Marr, J Daniel Gezelter
The Journal of Chemical Physics
|
June 24, 2008
Langevin dynamics for rigid bodies of arbitrary shape
Xiuquan Sun, Teng Lin, J Daniel Gezelter
The Journal of Chemical Physics
|
October 3, 2023
A theory of pitch for the hydrodynamic properties of molecules, helices, and achiral swimmers at low Reynolds number
Anderson D S Duraes, J Daniel Gezelter
The Journal of Physical Chemistry. B
|
October 15, 2021
Separation of Enantiomers through Local Vorticity: A Screw Model Mechanism
Anderson D S Duraes, J Daniel Gezelter
The Journal of Chemical Physics
|
October 10, 2014
Real space electrostatics for multipoles. I. Development of methods
Madan Lamichhane, J Daniel Gezelter, Kathie E Newman
The Journal of Chemical Physics
|
December 2, 2020
The role of polarizability in the interfacial thermal conductance at the gold-water interface
Hemanta Bhattarai, Kathie E Newman, J Daniel Gezelter
The Journal of Chemical Physics
|
October 10, 2014
Real space electrostatics for multipoles. II. Comparisons with the Ewald sum
Madan Lamichhane, Kathie E Newman, J Daniel Gezelter
Journal of Chemical Information and Modeling
|
June 11, 2026
Separation of Flexible Enantiomers Using Shear Flow
Minh Nhat Pham, Levi Cherek, J Daniel Gezelter
Page
of 4