C* M* Zicovich*
C* M* Zicovich*
Professor of physics, Autonomous U. of Morelos State
Email verificata su uaem.mx
Titolo
Citata da
Citata da
Anno
Crystal06
R Dovesi, VR Saunders, C Roetti, R Orlando, CM Zicovich-Wilson, ...
2827*2006
CRYSTAL14: A program for the ab initio investigation of crystalline solids
R Dovesi, R Orlando, A Erba, CM Zicovich‐Wilson, B Civalleri, S Casassa, ...
International Journal of Quantum Chemistry 114 (19), 1287-1317, 2014
12892014
CRYSTAL14 user’s manual
R Dovesi, VR Saunders, C Roetti, R Orlando, CM Zicovich-Wilson, ...
University of Torino, Torino, 382, 2014
8132014
The calculation of the vibrational frequencies of crystalline compounds and its implementation in the CRYSTAL code
F Pascale, CM Zicovich‐Wilson, F Lpez Gejo, B Civalleri, R Orlando, ...
Journal of computational chemistry 25 (6), 888-897, 2004
7752004
Quantum‐mechanical condensed matter simulations with CRYSTAL
R Dovesi, A Erba, R Orlando, CM Zicovich‐Wilson, B Civalleri, L Maschio, ...
Wiley Interdisciplinary Reviews: Computational Molecular Science 8 (4), e1360, 2018
6702018
B3LYP augmented with an empirical dispersion term (B3LYP-D*) as applied to molecular crystals
B Civalleri, CM Zicovich-Wilson, L Valenzano, P Ugliengo
CrystEngComm 10 (4), 405-410, 2008
6482008
CRYSTAL2003 user’s manual
VR Saunders, R Dovesi, C Roetti, R Orlando, CM Zicovich-Wilson, ...
University of Torino, Torino 14, 2003
4622003
Calculation of the vibration frequencies of α‐quartz: The effect of Hamiltonian and basis set
CM Zicovich‐Wilson, F Pascale, C Roetti, VR Saunders, R Orlando, ...
Journal of computational chemistry 25 (15), 1873-1881, 2004
4132004
Gradient damage models and their use to approximate brittle fracture
K Pham, H Amor, JJ Marigo, C Maurini
International Journal of Damage Mechanics 20 (4), 618-652, 2011
3612011
Polarization properties of ZnO and BeO: An ab initio study through the Berry phase and Wannier functions approaches
Y Noel, CM Zicovich-Wilson, B Civalleri, P D’arco, R Dovesi
Physical Review B 65 (1), 014111, 2001
2452001
A general method to obtain well localized Wannier functions for composite energy bands in linear combination of atomic orbital periodic calculations
CM Zicovich-Wilson, R Dovesi, VR Saunders
The Journal of Chemical Physics 115 (21), 9708-9719, 2001
2242001
Local-MP2 electron correlation method for nonconducting crystals
C Pisani, M Busso, G Capecchi, S Casassa, R Dovesi, L Maschio, ...
The Journal of chemical physics 122 (9), 094113, 2005
2212005
Preferential location of Ge in the double four-membered ring units of ITQ-7 zeolite
T Blasco, A Corma, MJ Daz-Cabaas, F Rey, JA Vidal-Moya, ...
The Journal of Physical Chemistry B 106 (10), 2634-2642, 2002
2102002
Exceptionally low shear modulus in a prototypical imidazole-based metal-organic framework
JC Tan, B Civalleri, CC Lin, L Valenzano, R Galvelis, PF Chen, ...
Physical review letters 108 (9), 095502, 2012
2012012
The vibrational spectrum of calcite (CaCO 3): an ab initio quantum-mechanical calculation
M Prencipe, F Pascale, CM Zicovich-Wilson, VR Saunders, R Orlando, ...
Physics and Chemistry of Minerals 31 (8), 559-564, 2004
1992004
Ab Initio Study of the Vibrational Spectrum and Related Properties of Crystalline Compounds; the Case of CaCO3 Calcite
L Valenzano, FJ Torres, K Doll, F Pascale, CM Zicovich-Wilson, R Dovesi
Oldenbourg Wissenschaftsverlag 220 (7), 893-912, 2006
1922006
Flexibility in a metal–organic framework material controlled by weak dispersion forces: the bistability of MIL‐53 (Al)
AM Walker, B Civalleri, B Slater, C Mellot‐Draznieks, F Cor, ...
Angewandte Chemie 122 (41), 7663-7665, 2010
1612010
Electronic confinement of molecules in microscopic pores. A new concept which contributes to the explanation of the catalytic activity of zeolites
CM Zicovich-Wilson, A Corma, P Viruela
The Journal of Physical Chemistry 98 (42), 10863-10870, 1994
1491994
Vibrational spectrum of brucite, Mg (OH) 2: a periodic ab initio quantum mechanical calculation including OH anharmonicity
F Pascale, S Tosoni, C Zicovich-Wilson, P Ugliengo, R Orlando, R Dovesi
Chemical Physics Letters 396 (4-6), 308-315, 2004
1442004
Wiley Interdiscip
R Dovesi, A Erba, R Orlando, CM Zicovich-Wilson, B Civalleri, L Maschio, ...
Rev.: Comput. Mol. Sci 8 (4), e1360, 2018
1432018
Il sistema al momento non pu eseguire l'operazione. Riprova pi tardi.
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