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Víctor Luaña
Víctor Luaña
Universidad de Oviedo (Profesor de Química Física)
Подтвержден адрес электронной почты в домене fluor.quimica.uniovi.es - Главная страница
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GIBBS: isothermal-isobaric thermodynamics of solids from energy curves using a quasi-harmonic Debye model
MA Blanco, E Francisco, V Luana
Computer Physics Communications 158 (1), 57-72, 2004
19562004
Gibbs2: A new version of the quasiharmonic model code. II. Models for solid-state thermodynamics, features and implementation
A Otero-de-la-Roza, D Abbasi-Pérez, V Luaña
Computer Physics Communications 182 (10), 2232-2248, 2011
7412011
Critic2: A program for real-space analysis of quantum chemical interactions in solids
A Otero-de-la-Roza, ER Johnson, V Luaña
Computer Physics Communications 185 (3), 1007-1018, 2014
5632014
Gibbs2: A new version of the quasi-harmonic model code. I. Robust treatment of the static data
A Otero-de-la-Roza, V Luaña
Computer Physics Communications 182 (8), 1708-1720, 2011
3322011
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
3002009
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
1902002
Non-nuclear maxima of the electron density
AM Pendás, MA Blanco, A Costales, PM Sánchez, V Luaña
Physical review letters 83 (10), 1930, 1999
1821999
Compressibility of the high-pressure rocksalt phase of ZnO
JM Recio, MA Blanco, V Luana, R Pandey, L Gerward, JS Olsen
Physical Review B 58 (14), 8949, 1998
1771998
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
1711997
Local compressibilities in crystals
AM Pendás, A Costales, MA Blanco, JM Recio, V Luaña
Physical Review B 62 (21), 13970, 2000
1582000
Simulation of ionic crystals: The ab initio perturbed-ion method and application to alkali hydrides and halides
V Luaña, L Pueyo
Physical Review B 41 (6), 3800, 1990
1561990
Ions in crystals: The topology of the electron density in ionic materials. II. The cubic alkali halide perovskites
V Luaña, A Costales, AM Pendás
Physical Review B 55 (7), 4285, 1997
1441997
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
1331998
Equations of state and thermodynamics of solids using empirical corrections in the quasiharmonic approximation
A Otero-de-la-Roza, V Luaña
Physical Review B 84 (18), 184103, 2011
912011
Pressure-induced B1-B2 phase transition in alkali halides: General aspects from first-principles calculations
AM Pendás, V Luana, JM Recio, M Flórez, E Francisco, MA Blanco, ...
Physical Review B 49 (5), 3066, 1994
911994
Rigorous characterization of oxygen vacancies in ionic oxides
P Mori-Sanchez, JM Recio, B Silvi, C Sousa, AM Pendás, V Luaña, F Illas
Physical Review B 66 (7), 075103, 2002
872002
Topological analysis of chemical bonding in cyclophosphazenes
V Luaña, AM Pendas, A Costales, GA Carriedo, FJ García-Alonso
The Journal of Physical Chemistry A 105 (21), 5280-5291, 2001
822001
Non-nuclear maxima of the electron density on alkaline metals
V Luana, P Mori-Sánchez, A Costales, MA Blanco, AM Pendás
The Journal of chemical physics 119 (12), 6341-6350, 2003
692003
Elastic properties and bonding of the AgGaSe2 chalcopyrite
T Ouahrani, A Otero-de-la-Roza, AH Reshak, R Khenata, HI Faraoun, ...
Physica B: Condensed Matter 405 (17), 3658-3664, 2010
652010
Supramolecular architectures based on As (lone pair)⋯ π (aryl) interactions
J Zukerman-Schpector, A Otero-de-la-Roza, V Luaña, ERT Tiekink
Chemical communications 47 (27), 7608-7610, 2011
632011
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