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The Journal of Chemical Physics
|
November 11, 2011
Rapid calculation of partition functions and free energies of fluids
Hainam Do, Jonathan D Hirst, Richard J Wheatley
The Journal of Physical Chemistry. B
|
March 17, 2012
Calculation of partition functions and free energies of a binary mixture using the energy partitioning method: application to carbon dioxide and methane
Hainam Do, Jonathan D Hirst, Richard J Wheatley
Physical Chemistry Chemical Physics : PCCP
|
September 11, 2010
Microscopic structure of liquid 1-1-1-2-tetrafluoroethane (R134a) from Monte Carlo simulation
Hainam Do, Richard J Wheatley, Jonathan D Hirst
The Journal of Physical Chemistry. B
|
June 19, 2013
Computational study of the structure and electronic circular dichroism spectroscopy of blue copper proteins
Hainam Do, Robert J Deeth, Nicholas A Besley
The Journal of Physical Chemistry. B
|
July 22, 2024
An Improved Diabatization Scheme for Computing the Electronic Circular Dichroism of Proteins
David M Rogers, Hainam Do, Jonathan D Hirst
Nano Letters
|
December 26, 2023
Molecular-Level Anion and Li<sup>+</sup> Co-Regulation by Amphoteric Polymer Separator for High-Rate Stable Lithium Metal Anode
Shizhen Li, Hangqi Yang, Mengzi Geng, et al.
Journal of Chemical Theory and Computation
|
July 11, 2020
Force Fields for Macromolecular Assemblies Containing Diketopyrrolopyrrole and Thiophene
Ling Jiang, David M Rogers, Jonathan D Hirst, et al.
The Journal of Chemical Physics
|
March 25, 2011
First principles predictions of thermophysical properties of refrigerant mixtures
Mark T Oakley, Hainam Do, Jonathan D Hirst, et al.
Small (Weinheim an Der Bergstrasse, Germany)
|
March 17, 2022
Harnessing Heteropolar Lithium Polysulfides by Amphoteric Polymer Binder for Facile Manufacturing of Practical Li-S Batteries
Shizhen Li, Wenshan Xiao, Hainam Do, et al.
Physical Review. E
|
June 25, 2020
Cluster integrals and virial coefficients for realistic molecular models
Richard J Wheatley, Andrew J Schultz, Hainam Do, et al.
Page
of 5
Search research articles
Search
Showing results (11-20 of 41) with videos related to
Sort By:
Page
of 5
The Journal of Chemical Physics
|
November 11, 2011
Rapid calculation of partition functions and free energies of fluids
Hainam Do, Jonathan D Hirst, Richard J Wheatley
The Journal of Physical Chemistry. B
|
March 17, 2012
Calculation of partition functions and free energies of a binary mixture using the energy partitioning method: application to carbon dioxide and methane
Hainam Do, Jonathan D Hirst, Richard J Wheatley
Physical Chemistry Chemical Physics : PCCP
|
September 11, 2010
Microscopic structure of liquid 1-1-1-2-tetrafluoroethane (R134a) from Monte Carlo simulation
Hainam Do, Richard J Wheatley, Jonathan D Hirst
The Journal of Physical Chemistry. B
|
June 19, 2013
Computational study of the structure and electronic circular dichroism spectroscopy of blue copper proteins
Hainam Do, Robert J Deeth, Nicholas A Besley
The Journal of Physical Chemistry. B
|
July 22, 2024
An Improved Diabatization Scheme for Computing the Electronic Circular Dichroism of Proteins
David M Rogers, Hainam Do, Jonathan D Hirst
Nano Letters
|
December 26, 2023
Molecular-Level Anion and Li<sup>+</sup> Co-Regulation by Amphoteric Polymer Separator for High-Rate Stable Lithium Metal Anode
Shizhen Li, Hangqi Yang, Mengzi Geng, et al.
Journal of Chemical Theory and Computation
|
July 11, 2020
Force Fields for Macromolecular Assemblies Containing Diketopyrrolopyrrole and Thiophene
Ling Jiang, David M Rogers, Jonathan D Hirst, et al.
The Journal of Chemical Physics
|
March 25, 2011
First principles predictions of thermophysical properties of refrigerant mixtures
Mark T Oakley, Hainam Do, Jonathan D Hirst, et al.
Small (Weinheim an Der Bergstrasse, Germany)
|
March 17, 2022
Harnessing Heteropolar Lithium Polysulfides by Amphoteric Polymer Binder for Facile Manufacturing of Practical Li-S Batteries
Shizhen Li, Wenshan Xiao, Hainam Do, et al.
Physical Review. E
|
June 25, 2020
Cluster integrals and virial coefficients for realistic molecular models
Richard J Wheatley, Andrew J Schultz, Hainam Do, et al.
Page
of 5