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Paul W Ayers

Showing results (1-10 of 217) with videos related to

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Journal of Molecular Modeling|October 23, 2012
The density per particle can be used as the fundamental descriptor for systems with rapidly decaying external potentialsPaul W Ayers
The Journal of Chemical Physics|January 26, 2024
Energy is not a convex function of particle number for r-k interparticle potentials with k > log34Paul W Ayers
Physical Chemistry Chemical Physics : PCCP|July 21, 2006
Can one oxidize an atom by reducing the molecule that contains it?Paul W Ayers
Faraday Discussions|March 3, 2007
The physical basis of the hard/soft acid/base principlePaul W Ayers
The Journal of Chemical Physics|April 26, 2005
An elementary derivation of the hard/soft-acid/base principlePaul W Ayers
Journal of Chemical Theory and Computation|November 18, 2015
Linearized Coupled Cluster Correction on the Antisymmetric Product of 1-Reference Orbital GeminalsKatharina Boguslawski, Paul W Ayers
Physical Chemistry Chemical Physics : PCCP|July 13, 2013
How reliable is the hard-soft acid-base principle? An assessment from numerical simulations of electron transfer energiesCarlos Cárdenas, Paul W Ayers
The Journal of Chemical Physics|April 21, 2007
Alternatives to the electron density for describing Coulomb systemsPaul W Ayers, Agnes Nagy
The Journal of Chemical Physics|May 17, 2014
Tight constraints on the exchange-correlation potentials of degenerate statesPaul W Ayers, Mel Levy
The Journal of Chemical Physics|April 25, 2009
An electron-preceding perspective on the deformation of materialsPaul W Ayers, Samantha Jenkins
Pageof 22

Showing results (1-10 of 217) with videos related to

Sort By:
Pageof 22
Journal of Molecular Modeling|October 23, 2012
The density per particle can be used as the fundamental descriptor for systems with rapidly decaying external potentialsPaul W Ayers
The Journal of Chemical Physics|January 26, 2024
Energy is not a convex function of particle number for r-k interparticle potentials with k > log34Paul W Ayers
Physical Chemistry Chemical Physics : PCCP|July 21, 2006
Can one oxidize an atom by reducing the molecule that contains it?Paul W Ayers
Faraday Discussions|March 3, 2007
The physical basis of the hard/soft acid/base principlePaul W Ayers
The Journal of Chemical Physics|April 26, 2005
An elementary derivation of the hard/soft-acid/base principlePaul W Ayers
Journal of Chemical Theory and Computation|November 18, 2015
Linearized Coupled Cluster Correction on the Antisymmetric Product of 1-Reference Orbital GeminalsKatharina Boguslawski, Paul W Ayers
Physical Chemistry Chemical Physics : PCCP|July 13, 2013
How reliable is the hard-soft acid-base principle? An assessment from numerical simulations of electron transfer energiesCarlos Cárdenas, Paul W Ayers
The Journal of Chemical Physics|April 21, 2007
Alternatives to the electron density for describing Coulomb systemsPaul W Ayers, Agnes Nagy
The Journal of Chemical Physics|May 17, 2014
Tight constraints on the exchange-correlation potentials of degenerate statesPaul W Ayers, Mel Levy
The Journal of Chemical Physics|April 25, 2009
An electron-preceding perspective on the deformation of materialsPaul W Ayers, Samantha Jenkins
Pageof 22