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Physical Review Letters
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September 26, 2012
Accurate and efficient method for many-body van der Waals interactions
Alexandre Tkatchenko, Robert A DiStasio, Roberto Car, et al.
Journal of Chemical Theory and Computation
|
November 27, 2015
Non-Covalent Interactions with Dual-Basis Methods: Pairings for Augmented Basis Sets
Ryan P Steele, Robert A DiStasio, Martin Head-Gordon
Proceedings of the National Academy of Sciences of the United States of America
|
August 28, 2012
Collective many-body van der Waals interactions in molecular systems
Robert A DiStasio, O Anatole von Lilienfeld, Alexandre Tkatchenko
Science (New York, N.Y.)
|
March 12, 2016
Wavelike charge density fluctuations and van der Waals interactions at the nanoscale
Alberto Ambrosetti, Nicola Ferri, Robert A DiStasio, et al.
The Journal of Chemical Physics
|
September 11, 2009
Dispersion-corrected Møller-Plesset second-order perturbation theory
Alexandre Tkatchenko, Robert A DiStasio, Martin Head-Gordon, et al.
The Journal of Chemical Physics
|
December 4, 2018
On the geometric dependence of the molecular dipole polarizability in water: A benchmark study of higher-order electron correlation, basis set incompleteness error, core electron effects, and zero-point vibrational contributions
Ka Un Lao, Junteng Jia, Rahul Maitra, et al.
Physical Review. E
|
March 18, 2018
Rational design of stealthy hyperuniform two-phase media with tunable order
Robert A DiStasio, Ge Zhang, Frank H Stillinger, et al.
The Journal of Chemical Physics
|
May 17, 2014
Long-range correlation energy calculated from coupled atomic response functions
Alberto Ambrosetti, Anthony M Reilly, Robert A DiStasio, et al.
The Journal of Physical Chemistry. A
|
December 22, 2006
Dual-basis analytic gradients. 1. Self-consistent field theory
Ryan P Steele, Yihan Shao, Robert A DiStasio, et al.
Physical Review Letters
|
May 16, 2015
Electronic properties of molecules and surfaces with a self-consistent interatomic van der Waals density functional
Nicola Ferri, Robert A DiStasio, Alberto Ambrosetti, et al.
Page
of 6
Search research articles
Search
Showing results (11-20 of 56) with videos related to
Sort By:
Page
of 6
Physical Review Letters
|
September 26, 2012
Accurate and efficient method for many-body van der Waals interactions
Alexandre Tkatchenko, Robert A DiStasio, Roberto Car, et al.
Journal of Chemical Theory and Computation
|
November 27, 2015
Non-Covalent Interactions with Dual-Basis Methods: Pairings for Augmented Basis Sets
Ryan P Steele, Robert A DiStasio, Martin Head-Gordon
Proceedings of the National Academy of Sciences of the United States of America
|
August 28, 2012
Collective many-body van der Waals interactions in molecular systems
Robert A DiStasio, O Anatole von Lilienfeld, Alexandre Tkatchenko
Science (New York, N.Y.)
|
March 12, 2016
Wavelike charge density fluctuations and van der Waals interactions at the nanoscale
Alberto Ambrosetti, Nicola Ferri, Robert A DiStasio, et al.
The Journal of Chemical Physics
|
September 11, 2009
Dispersion-corrected Møller-Plesset second-order perturbation theory
Alexandre Tkatchenko, Robert A DiStasio, Martin Head-Gordon, et al.
The Journal of Chemical Physics
|
December 4, 2018
On the geometric dependence of the molecular dipole polarizability in water: A benchmark study of higher-order electron correlation, basis set incompleteness error, core electron effects, and zero-point vibrational contributions
Ka Un Lao, Junteng Jia, Rahul Maitra, et al.
Physical Review. E
|
March 18, 2018
Rational design of stealthy hyperuniform two-phase media with tunable order
Robert A DiStasio, Ge Zhang, Frank H Stillinger, et al.
The Journal of Chemical Physics
|
May 17, 2014
Long-range correlation energy calculated from coupled atomic response functions
Alberto Ambrosetti, Anthony M Reilly, Robert A DiStasio, et al.
The Journal of Physical Chemistry. A
|
December 22, 2006
Dual-basis analytic gradients. 1. Self-consistent field theory
Ryan P Steele, Yihan Shao, Robert A DiStasio, et al.
Physical Review Letters
|
May 16, 2015
Electronic properties of molecules and surfaces with a self-consistent interatomic van der Waals density functional
Nicola Ferri, Robert A DiStasio, Alberto Ambrosetti, et al.
Page
of 6