CIVALLERI, Bartolomeo

CIVALLERI, Bartolomeo  

CHIMICA  

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Titolo Data di pubblicazione Autore(i) File
Ab initio investigation of the interaction of H2 with lithium exchanged low-silica chabazites 2008 B. Civalleri; F. J. Torres; R. Demichelis; A. Terentyev; P. Ugliengo
Ab initio QM study of hydroxyapatite (001) and (100) surfaces 2006 M. Corno; P. Ugliengo; B. Civalleri; C. Busco
Ab-Initio Fully Periodic Characterization of MOF-74-M (M = Mg, Mn, Ni, Zn): Structures and Enthalpies of Adsorption 2011 L. Valenzano; B. Civalleri; W. F. Perger
AB-INITIO QM STUDY ON HYDROXYAPATITE (001) AND (100) SURFACES 2005 M. Corno; P. Ugliengo; B. Civalleri; C. Busco
Combined study of structural properties of metal-organic frameworks changing organic linkers and metal centers 2011 Diego Gianolio; Jenny Grazia Vitillo; Bartolomeo Civalleri; Silvia Bordiga; Merete Hansen Nilsen; Soren Jakobsen; Karl Petter Lillerud; Loredana Valenzano; Carlo Lamberti
Combined study of structural properties on metal-organic frameworks with same topology but different linkers or metal 2013 D. Gianolio; J. G. Vitillo; B. Civalleri; S. Bordiga; U. Olsbye; K. P. Lillerud; L. Valenzano; C. Lamberti
Hydroxylated crystalline edingtonite silica faces as models for the amorphous silica surface 2008 S. Tosoni; B. Civalleri; F. Pascale; P. Ugliengo
Polarizability and charge density distribution in crystalline urea 2012 Mauro Ferrero;Bartolomeo Civalleri;Michel Rérat
Role of Calcium Hydroxyapatite in Bioglasses: an Ab-Initio Study 2006 M. Corno; C. Busco; B. Civalleri; A. Pedone; P. Ugliengo
Structure-activity relationships of simple molecules adsorbed on MOF materials: in situ experiments vs. theory 2011 C. Lamberti; L. Valenzano; B. Civalleri; J.G. Vitillo; F. Bonino; S. Bordiga; S. Chavan