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Physical Chemistry Chemical Physics : PCCP
|
September 10, 2015
Developing accurate molecular mechanics force fields for conjugated molecular systems
Hainam Do, Alessandro Troisi
Physical Chemistry Chemical Physics : PCCP
|
January 7, 2015
Calculation of the vibrational frequencies of carbon clusters and fullerenes with empirical potentials
Hainam Do, Nicholas A Besley
The Journal of Chemical Physics
|
October 9, 2012
Structural optimization of molecular clusters with density functional theory combined with basin hopping
Hainam Do, Nicholas A Besley
The Journal of Chemical Physics
|
September 3, 2016
Reverse energy partitioning-An efficient algorithm for computing the density of states, partition functions, and free energy of solids
Hainam Do, Richard J Wheatley
Physical Chemistry Chemical Physics : PCCP
|
September 3, 2013
Proton transfer or hemibonding? The structure and stability of radical cation clusters
Hainam Do, Nicholas A Besley
The Journal of Physical Chemistry. A
|
June 7, 2013
Structure and bonding in ionized water clusters
Hainam Do, Nicholas A Besley
Journal of Chemical Theory and Computation
|
November 22, 2015
Density of States Partitioning Method for Calculating the Free Energy of Solids
Hainam Do, Richard J Wheatley
The Journal of Physical Chemistry. A
|
July 27, 2012
Theoretical study of the electronic spectra of small molecules that incorporate analogues of the copper-cysteine bond
Hainam Do, Nicholas A Besley
The Journal of Physical Chemistry. B
|
February 27, 2010
Gibbs ensemble Monte Carlo simulations of binary mixtures of methane, difluoromethane, and carbon dioxide
Hainam Do, Richard J Wheatley, Jonathan D Hirst
Physical Chemistry Chemical Physics : PCCP
|
July 30, 2011
Molecular simulation of the binary mixture of 1-1-1-2-tetrafluoroethane and carbon dioxide
Hainam Do, Richard J Wheatley, Jonathan D Hirst
Page
of 5
Search research articles
Search
Showing results (1-10 of 41) with videos related to
Sort By:
Page
of 5
Physical Chemistry Chemical Physics : PCCP
|
September 10, 2015
Developing accurate molecular mechanics force fields for conjugated molecular systems
Hainam Do, Alessandro Troisi
Physical Chemistry Chemical Physics : PCCP
|
January 7, 2015
Calculation of the vibrational frequencies of carbon clusters and fullerenes with empirical potentials
Hainam Do, Nicholas A Besley
The Journal of Chemical Physics
|
October 9, 2012
Structural optimization of molecular clusters with density functional theory combined with basin hopping
Hainam Do, Nicholas A Besley
The Journal of Chemical Physics
|
September 3, 2016
Reverse energy partitioning-An efficient algorithm for computing the density of states, partition functions, and free energy of solids
Hainam Do, Richard J Wheatley
Physical Chemistry Chemical Physics : PCCP
|
September 3, 2013
Proton transfer or hemibonding? The structure and stability of radical cation clusters
Hainam Do, Nicholas A Besley
The Journal of Physical Chemistry. A
|
June 7, 2013
Structure and bonding in ionized water clusters
Hainam Do, Nicholas A Besley
Journal of Chemical Theory and Computation
|
November 22, 2015
Density of States Partitioning Method for Calculating the Free Energy of Solids
Hainam Do, Richard J Wheatley
The Journal of Physical Chemistry. A
|
July 27, 2012
Theoretical study of the electronic spectra of small molecules that incorporate analogues of the copper-cysteine bond
Hainam Do, Nicholas A Besley
The Journal of Physical Chemistry. B
|
February 27, 2010
Gibbs ensemble Monte Carlo simulations of binary mixtures of methane, difluoromethane, and carbon dioxide
Hainam Do, Richard J Wheatley, Jonathan D Hirst
Physical Chemistry Chemical Physics : PCCP
|
July 30, 2011
Molecular simulation of the binary mixture of 1-1-1-2-tetrafluoroethane and carbon dioxide
Hainam Do, Richard J Wheatley, Jonathan D Hirst
Page
of 5