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Ángel Martín Pendás
Ángel Martín Pendás
Profesor de Química Física (UOV)
Подтвержден адрес электронной почты в домене uniovi.es
Название
Процитировано
Процитировано
Год
Interacting quantum atoms: a correlated energy decomposition scheme based on the quantum theory of atoms in molecules
MA Blanco, A Martín Pendás, E Francisco
Journal of Chemical Theory and Computation 1 (6), 1096-1109, 2005
5682005
First-principles study of the rocksalt–cesium chloride relative phase stability in alkali halides
M Flórez, JM Recio, E Francisco, MA Blanco, AM Pendás
Physical Review B 66 (14), 144112, 2002
5452002
Thermodynamical properties of solids from microscopic theory: applications to MgF2 and Al2O3
MA Blanco, AM Pendás, E Francisco, JM Recio, R Franco
Journal of Molecular Structure: THEOCHEM 368, 245-255, 1996
4931996
Quantum-mechanical study of thermodynamic and bonding properties of MgF2
E Francisco, JM Recio, MA Blanco, AM Pendás, A Costales
The Journal of Physical Chemistry A 102 (9), 1595-1601, 1998
4801998
A Guided Tour Through Modern Charge Density Analysis
C Gatti, P Macchi
Modern Charge-Density Analysis, 1-78, 2011
3272011
Bond paths as privileged exchange channels
AM Pendás, E Francisco, MA Blanco, C Gatti
Chemistry–A European Journal 13 (33), 9362-9371, 2007
3022007
A molecular energy decomposition scheme for atoms in molecules
E Francisco, A Martín Pendás, MA Blanco
Journal of Chemical Theory and Computation 2 (1), 90-102, 2006
2612006
Critic: a new program for the topological analysis of solid-state electron densities
A Otero-de-la-Roza, MA Blanco, AM Pendás, V Luaña
Computer Physics Communications 180 (1), 157-166, 2009
2312009
The nature of the hydrogen bond: A synthesis from the interacting quantum atoms picture
A Martín Pendás, MA Blanco, E Francisco
The Journal of chemical physics 125 (18), 184112, 2006
2202006
Applications of 5S rDNA in Atlantic salmon, brown trout, and in Atlantic salmon x brown trout hybrid identification
AM Pendas, P Moran, JL Martinez, E Garcia-Vazquez
Molecular Ecology 4 (2), 275-276, 1995
1771995
A classification of covalent, ionic, and metallic solids based on the electron density
P Mori-Sánchez, AM Pendás, V Luaña
Journal of the American Chemical Society 124 (49), 14721-14723, 2002
1692002
Non-nuclear maxima of the electron density
AM Pendás, MA Blanco, A Costales, PM Sánchez, V Luaña
Physical review letters 83 (10), 1930, 1999
1591999
Ions in crystals: The topology of the electron density in ionic materials. I. Fundamentals
AM Pendás, A Costales, V Luaña
Physical Review B 55 (7), 4275, 1997
1581997
Two-electron integrations in the quantum theory of atoms in molecules
AM Pendás, MA Blanco, E Francisco
The Journal of chemical physics 120 (10), 4581-4592, 2004
1532004
Chemical fragments in real space: definitions, properties, and energetic decompositions
AM Pendás, MA Blanco, E Francisco
Journal of Computational Chemistry 28 (1), 161-184, 2007
1462007
Local compressibilities in crystals
AM Pendás, A Costales, MA Blanco, JM Recio, V Luaña
Physical Review B 62 (21), 13970, 2000
1402000
Ions in crystals: The topology of the electron density in ionic materials. II. The cubic alkali halide perovskites
V Luana, A Costales, AM Pendás
Physical Review B 55 (7), 4285, 1997
1371997
Theoretical explanation of the uniform compressibility behavior observed in oxide spinels
JM Recio, R Franco, AM Pendás, MA Blanco, L Pueyo, R Pandey
Physical Review B 63 (18), 184101, 2001
1212001
Ions in crystals: the topology of the electron density in ionic materials. III. Geometry and ionic radii
AM Pendás, A Costales, V Luana
The Journal of Physical Chemistry B 102 (36), 6937-6948, 1998
1201998
Extension of the interacting quantum atoms (IQA) approach to B3LYP level density functional theory (DFT)
P Maxwell, ÁM Pendás, PLA Popelier
Physical Chemistry Chemical Physics 18 (31), 20986-21000, 2016
1162016
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Статьи 1–20