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The Journal of Chemical Physics
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July 3, 2014
Communication: the description of strong correlation within self-consistent Green's function second-order perturbation theory
Jordan J Phillips, Dominika Zgid
The Journal of Chemical Physics
|
November 18, 2011
Magnetic exchange couplings from constrained density functional theory: an efficient approach utilizing analytic derivatives
Jordan J Phillips, Juan E Peralta
The Journal of Chemical Physics
|
May 10, 2013
Towards the blackbox computation of magnetic exchange coupling parameters in polynuclear transition-metal complexes: theory, implementation, and application
Jordan J Phillips, Juan E Peralta
The Journal of Chemical Physics
|
January 26, 2011
The role of range-separated Hartree-Fock exchange in the calculation of magnetic exchange couplings in transition metal complexes
Jordan J Phillips, Juan E Peralta
The Journal of Physical Chemistry. A
|
February 21, 2014
Magnetic exchange couplings from noncollinear perturbation theory: dinuclear CuII complexes
Jordan J Phillips, Juan E Peralta
Journal of Chemical Theory and Computation
|
November 26, 2015
Magnetic Exchange Couplings from Semilocal Functionals Evaluated Nonself-Consistently on Hybrid Densities: Insights on Relative Importance of Exchange, Correlation, and Delocalization
Jordan J Phillips, Juan E Peralta
Journal of Chemical Theory and Computation
|
January 7, 2016
Efficient Temperature-Dependent Green's Functions Methods for Realistic Systems: Compact Grids for Orthogonal Polynomial Transforms
Alexei A Kananenka, Jordan J Phillips, Dominika Zgid
Journal of Chemical Theory and Computation
|
November 24, 2015
[Not Available]
Jordan J Phillips, Juan E Peralta, George Christou
The Journal of Chemical Physics
|
May 24, 2015
Fractional charge and spin errors in self-consistent Green's function theory
Jordan J Phillips, Alexei A Kananenka, Dominika Zgid
The Journal of Chemical Physics
|
November 24, 2014
Local Hamiltonians for quantitative Green's function embedding methods
Alexander A Rusakov, Jordan J Phillips, Dominika Zgid
Page
of 2
Search research articles
Search
Showing results (1-10 of 12) with videos related to
Sort By:
Page
of 2
The Journal of Chemical Physics
|
July 3, 2014
Communication: the description of strong correlation within self-consistent Green's function second-order perturbation theory
Jordan J Phillips, Dominika Zgid
The Journal of Chemical Physics
|
November 18, 2011
Magnetic exchange couplings from constrained density functional theory: an efficient approach utilizing analytic derivatives
Jordan J Phillips, Juan E Peralta
The Journal of Chemical Physics
|
May 10, 2013
Towards the blackbox computation of magnetic exchange coupling parameters in polynuclear transition-metal complexes: theory, implementation, and application
Jordan J Phillips, Juan E Peralta
The Journal of Chemical Physics
|
January 26, 2011
The role of range-separated Hartree-Fock exchange in the calculation of magnetic exchange couplings in transition metal complexes
Jordan J Phillips, Juan E Peralta
The Journal of Physical Chemistry. A
|
February 21, 2014
Magnetic exchange couplings from noncollinear perturbation theory: dinuclear CuII complexes
Jordan J Phillips, Juan E Peralta
Journal of Chemical Theory and Computation
|
November 26, 2015
Magnetic Exchange Couplings from Semilocal Functionals Evaluated Nonself-Consistently on Hybrid Densities: Insights on Relative Importance of Exchange, Correlation, and Delocalization
Jordan J Phillips, Juan E Peralta
Journal of Chemical Theory and Computation
|
January 7, 2016
Efficient Temperature-Dependent Green's Functions Methods for Realistic Systems: Compact Grids for Orthogonal Polynomial Transforms
Alexei A Kananenka, Jordan J Phillips, Dominika Zgid
Journal of Chemical Theory and Computation
|
November 24, 2015
[Not Available]
Jordan J Phillips, Juan E Peralta, George Christou
The Journal of Chemical Physics
|
May 24, 2015
Fractional charge and spin errors in self-consistent Green's function theory
Jordan J Phillips, Alexei A Kananenka, Dominika Zgid
The Journal of Chemical Physics
|
November 24, 2014
Local Hamiltonians for quantitative Green's function embedding methods
Alexander A Rusakov, Jordan J Phillips, Dominika Zgid
Page
of 2