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The Journal of Chemical Physics
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August 8, 2016
Size consistent formulations of the perturb-then-diagonalize Møller-Plesset perturbation theory correction to non-orthogonal configuration interaction
Shane R Yost, Martin Head-Gordon
The Journal of Physical Chemistry. B
|
December 12, 2007
Dielectric relaxation of aqueous solutions of hydrophilic versus amphiphilic peptides
Rajesh K Murarka, Teresa Head-Gordon
Journal of Chemical Theory and Computation
|
October 15, 2024
Smoother Semiclassical Dispersion for Density Functional Theory via D3S: Understanding and Addressing Unphysical Minima in the D3 Dispersion Correction Model
Nikolay V Tkachenko, Martin Head-Gordon
The Journal of Physical Chemistry. A
|
May 25, 2007
Scaled second-order perturbation corrections to configuration interaction singles: efficient and reliable excitation energy methods
Young Min Rhee, Martin Head-Gordon
The Journal of Chemical Physics
|
August 21, 2007
Correction to constrained coupled cluster doubles models based on the second coupled cluster central moment
David W Small, Martin Head-Gordon
The Journal of Chemical Physics
|
July 17, 2017
Coupled cluster valence bond theory for open-shell systems with application to very long range strong correlation in a polycarbene dimer
David W Small, Martin Head-Gordon
The Journal of Physical Chemistry Letters
|
August 13, 2015
Family of Oxygen-Oxygen Radial Distribution Functions for Water
David H Brookes, Teresa Head-Gordon
The Journal of Chemical Physics
|
July 17, 2010
A tractable and accurate electronic structure method for static correlations: the perfect hextuples model
John A Parkhill, Martin Head-Gordon
The Journal of Physical Chemistry. A
|
August 11, 2006
On the nature of unrestricted orbitals in variational active space wave functions
Gregory J Beran, Martin Head-Gordon
The Journal of Chemical Physics
|
May 5, 2007
Orbital-optimized opposite-spin scaled second-order correlation: an economical method to improve the description of open-shell molecules
Rohini C Lochan, Martin Head-Gordon
Page
of 65
Search research articles
Search
Showing results (91-100 of 649) with videos related to
Sort By:
Page
of 65
The Journal of Chemical Physics
|
August 8, 2016
Size consistent formulations of the perturb-then-diagonalize Møller-Plesset perturbation theory correction to non-orthogonal configuration interaction
Shane R Yost, Martin Head-Gordon
The Journal of Physical Chemistry. B
|
December 12, 2007
Dielectric relaxation of aqueous solutions of hydrophilic versus amphiphilic peptides
Rajesh K Murarka, Teresa Head-Gordon
Journal of Chemical Theory and Computation
|
October 15, 2024
Smoother Semiclassical Dispersion for Density Functional Theory via D3S: Understanding and Addressing Unphysical Minima in the D3 Dispersion Correction Model
Nikolay V Tkachenko, Martin Head-Gordon
The Journal of Physical Chemistry. A
|
May 25, 2007
Scaled second-order perturbation corrections to configuration interaction singles: efficient and reliable excitation energy methods
Young Min Rhee, Martin Head-Gordon
The Journal of Chemical Physics
|
August 21, 2007
Correction to constrained coupled cluster doubles models based on the second coupled cluster central moment
David W Small, Martin Head-Gordon
The Journal of Chemical Physics
|
July 17, 2017
Coupled cluster valence bond theory for open-shell systems with application to very long range strong correlation in a polycarbene dimer
David W Small, Martin Head-Gordon
The Journal of Physical Chemistry Letters
|
August 13, 2015
Family of Oxygen-Oxygen Radial Distribution Functions for Water
David H Brookes, Teresa Head-Gordon
The Journal of Chemical Physics
|
July 17, 2010
A tractable and accurate electronic structure method for static correlations: the perfect hextuples model
John A Parkhill, Martin Head-Gordon
The Journal of Physical Chemistry. A
|
August 11, 2006
On the nature of unrestricted orbitals in variational active space wave functions
Gregory J Beran, Martin Head-Gordon
The Journal of Chemical Physics
|
May 5, 2007
Orbital-optimized opposite-spin scaled second-order correlation: an economical method to improve the description of open-shell molecules
Rohini C Lochan, Martin Head-Gordon
Page
of 65