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Physical Chemistry Chemical Physics : PCCP
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March 28, 2019
Reply to the 'Comment on "Decoding real space bonding descriptors in valence bond language"' by S. Shaik, P. Hiberty and D. Danovich, Phys. Chem. Chem. Phys., 2019, 21, DOI: 10.1039/C8CP07225F
A Martín Pendás, E Francisco
Physical Chemistry Chemical Physics : PCCP
|
September 30, 2021
Questioning the orbital picture of magnetic spin coupling: a real space alternative
A Martín Pendás, E Francisco
Physical Review. B, Condensed Matter
|
September 1, 1993
Low- and high-pressure ab initio equations of state for the alkali chlorides
Recio, Pendás, Francisco, et al.
Physical Review. B, Condensed Matter
|
March 1, 1994
Static simulations of CaF2 polymorphs
Pendás, Recio, Flórez, et al.
Physical Review. B, Condensed Matter
|
February 1, 1995
Derivation of electron-gas interatomic potentials from quantum-mechanical descriptions of ions in crystals
Francisco, Recio, Blanco, et al.
Journal of Chemical Information and Modeling
|
June 20, 2023
Developing a User-Friendly Code for the Fast Estimation of Well-Behaved Real-Space Partial Charges
Miguel Gallegos, Ángel Martín Pendás
Physical Chemistry Chemical Physics : PCCP
|
May 2, 2018
Decoding real space bonding descriptors in valence bond language
A Martín Pendás, E Francisco
The Journal of Chemical Physics
|
April 22, 2026
On the impact of nuclear quantum effects on quantum chemical topology
Martí Gimferrer, Ángel Martín Pendás
Iucrj
|
February 20, 2024
Persistence of atoms in molecules: there is room beyond electron densities
María Menéndez-Herrero, Ángel Martín Pendás
The Journal of Chemical Physics
|
October 9, 2012
The Ehrenfest force field: Topology and consequences for the definition of an atom in a molecule
A Martín Pendás, J Hernández-Trujillo
Page
of 37
Search research articles
Search
Showing results (11-20 of 361) with videos related to
Sort By:
Page
of 37
Physical Chemistry Chemical Physics : PCCP
|
March 28, 2019
Reply to the 'Comment on "Decoding real space bonding descriptors in valence bond language"' by S. Shaik, P. Hiberty and D. Danovich, Phys. Chem. Chem. Phys., 2019, 21, DOI: 10.1039/C8CP07225F
A Martín Pendás, E Francisco
Physical Chemistry Chemical Physics : PCCP
|
September 30, 2021
Questioning the orbital picture of magnetic spin coupling: a real space alternative
A Martín Pendás, E Francisco
Physical Review. B, Condensed Matter
|
September 1, 1993
Low- and high-pressure ab initio equations of state for the alkali chlorides
Recio, Pendás, Francisco, et al.
Physical Review. B, Condensed Matter
|
March 1, 1994
Static simulations of CaF2 polymorphs
Pendás, Recio, Flórez, et al.
Physical Review. B, Condensed Matter
|
February 1, 1995
Derivation of electron-gas interatomic potentials from quantum-mechanical descriptions of ions in crystals
Francisco, Recio, Blanco, et al.
Journal of Chemical Information and Modeling
|
June 20, 2023
Developing a User-Friendly Code for the Fast Estimation of Well-Behaved Real-Space Partial Charges
Miguel Gallegos, Ángel Martín Pendás
Physical Chemistry Chemical Physics : PCCP
|
May 2, 2018
Decoding real space bonding descriptors in valence bond language
A Martín Pendás, E Francisco
The Journal of Chemical Physics
|
April 22, 2026
On the impact of nuclear quantum effects on quantum chemical topology
Martí Gimferrer, Ángel Martín Pendás
Iucrj
|
February 20, 2024
Persistence of atoms in molecules: there is room beyond electron densities
María Menéndez-Herrero, Ángel Martín Pendás
The Journal of Chemical Physics
|
October 9, 2012
The Ehrenfest force field: Topology and consequences for the definition of an atom in a molecule
A Martín Pendás, J Hernández-Trujillo
Page
of 37