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The Journal of Physical Chemistry. A
|
January 28, 2009
Average local ionization energies in the Hartree-Fock and Kohn-Sham theories
Felipe A Bulat, Mel Levy, Peter Politzer
Nano Letters
|
April 1, 2009
Contact geometry and conductance of crossed nanotube junctions under pressure
Felipe A Bulat, Luise Couchman, Weitao Yang
Physical Review Letters
|
August 7, 2007
Optimized effective potentials in finite basis sets
Tim Heaton-Burgess, Felipe A Bulat, Weitao Yang
Journal of Molecular Modeling
|
April 23, 2010
Average local ionization energy: A review
Peter Politzer, Jane S Murray, Felipe A Bulat
Nano Letters
|
August 14, 2008
A donor-nanotube paradigm for nonlinear optical materials
Dequan Xiao, Felipe A Bulat, Weitao Yang, et al.
The Journal of Chemical Physics
|
November 13, 2007
Optimized effective potentials from electron densities in finite basis sets
Felipe A Bulat, Tim Heaton-Burgess, Aron J Cohen, et al.
The Journal of Chemical Physics
|
November 30, 2006
Density functional theory investigation of the polarizability and second hyperpolarizability of polydiacetylene and polybutatriene chains: treatment of exact exchange and role of correlation
Benoît Champagne, Felipe A Bulat, Weitao Yang, et al.
The Journal of Chemical Physics
|
July 23, 2005
Density-functional theory (hyper)polarizabilities of push-pull pi-conjugated systems: treatment of exact exchange and role of correlation
Felipe A Bulat, Alejandro Toro-Labbé, Benoît Champagne, et al.
Journal of Chemical Theory and Computation
|
November 25, 2015
Average Local Ionization Energies as a Route to Intrinsic Atomic Electronegativities
Peter Politzer, Zenaida Peralta-Inga Shields, Felipe A Bulat, et al.
Journal of Molecular Modeling
|
April 3, 2010
Quantitative analysis of molecular surfaces: areas, volumes, electrostatic potentials and average local ionization energies
Felipe A Bulat, Alejandro Toro-Labbé, Tore Brinck, et al.
Page
of 2
Search research articles
Search
Showing results (1-10 of 14) with videos related to
Sort By:
Page
of 2
The Journal of Physical Chemistry. A
|
January 28, 2009
Average local ionization energies in the Hartree-Fock and Kohn-Sham theories
Felipe A Bulat, Mel Levy, Peter Politzer
Nano Letters
|
April 1, 2009
Contact geometry and conductance of crossed nanotube junctions under pressure
Felipe A Bulat, Luise Couchman, Weitao Yang
Physical Review Letters
|
August 7, 2007
Optimized effective potentials in finite basis sets
Tim Heaton-Burgess, Felipe A Bulat, Weitao Yang
Journal of Molecular Modeling
|
April 23, 2010
Average local ionization energy: A review
Peter Politzer, Jane S Murray, Felipe A Bulat
Nano Letters
|
August 14, 2008
A donor-nanotube paradigm for nonlinear optical materials
Dequan Xiao, Felipe A Bulat, Weitao Yang, et al.
The Journal of Chemical Physics
|
November 13, 2007
Optimized effective potentials from electron densities in finite basis sets
Felipe A Bulat, Tim Heaton-Burgess, Aron J Cohen, et al.
The Journal of Chemical Physics
|
November 30, 2006
Density functional theory investigation of the polarizability and second hyperpolarizability of polydiacetylene and polybutatriene chains: treatment of exact exchange and role of correlation
Benoît Champagne, Felipe A Bulat, Weitao Yang, et al.
The Journal of Chemical Physics
|
July 23, 2005
Density-functional theory (hyper)polarizabilities of push-pull pi-conjugated systems: treatment of exact exchange and role of correlation
Felipe A Bulat, Alejandro Toro-Labbé, Benoît Champagne, et al.
Journal of Chemical Theory and Computation
|
November 25, 2015
Average Local Ionization Energies as a Route to Intrinsic Atomic Electronegativities
Peter Politzer, Zenaida Peralta-Inga Shields, Felipe A Bulat, et al.
Journal of Molecular Modeling
|
April 3, 2010
Quantitative analysis of molecular surfaces: areas, volumes, electrostatic potentials and average local ionization energies
Felipe A Bulat, Alejandro Toro-Labbé, Tore Brinck, et al.
Page
of 2