QUÍMICA TEÓRICA Y COMPUTACIONAL
QTCOVI
Universidad de Valladolid
Valladolid, EspañaPublicaciones en colaboración con investigadores/as de Universidad de Valladolid (5)
2011
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Ab initio benchmark calculations on Ca(II) complexes and assessment of density functional theory methodologies
Journal of Physical Chemistry A, Vol. 115, Núm. 41, pp. 11331-11343
2008
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Monoligand Zn(II) complexes: Ab initio benchmark calculations and comparison with density functional theory methodologies
Journal of Chemical Theory and Computation, Vol. 4, Núm. 2, pp. 243-256
1998
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Ab initio study of (NaCl) nNa+ clusters
Canadian Journal of Physics, Vol. 76, Núm. 4, pp. 311-320
1995
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Theoretical study of (NaCl)n clusters
Physica B: Physics of Condensed Matter, Vol. 212, Núm. 4, pp. 329-342
1993
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Theoretical study of NaCl clusters
Zeitschrift für Physik D Atoms, Molecules and Clusters, Vol. 26, Núm. 1 Supplement, pp. 213-215