CAUSA', Mauro
CAUSA', Mauro
DIPARTIMENTO DI INGEGNERIA CHIMICA, DEI MATERIALI E DELLA PRODUZIONE INDUSTRIALE
Bottom-up approach to innovative memory devices: I. Intrinsic and environmental effects on the molecular component
2008 Pino, Ilaria; Sementa, Luca; Causa', Mauro; Barone, Vincenzo
X-ray absorption spectroscopy of titanium oxide by time dependent density functional calculations
2006 Fronzoni, G; Francesco, R; Stener, M; Causa', Mauro
CRYSTAL98 User's Manual,
1999 Vr, Saunders; R., Dovesi; C., Roetti; Causa', Mauro; N. M., Harrison; R., Orlando; Cmzicovich, Wilson
Numerical Integration in Density Functional Methods with Linear Combination of Atomic Orbitals
1996 Causa', Mauro
Understanding Maximum Probability Domains with Simple Models
2012 J. L., Osvaldo; B., Braida; Causa', Mauro; A., Savin
Density-Gradient analysis for Density functional Theory: Application to atoms
1997 A., Zupan; J. P., Perdew; K., Burke; Causa', Mauro
Calculated Enthalpies of Mixing of Mno/mgo and Nio/mgo
1994 K. D., Heath; W. C., Mackrodt; V. R., Saunders; Causa', Mauro
Vibrational spectra and quantum chemical calculations of some polyfluoroethers
1998 S., Radice; Causa', Mauro; G., Marchionni
Density-functional Lcao Calculation of Periodic-systems - A-posteriori Correction of the Hartree-fock Energy of Covalent and Ionic-crystals
1994 Causa', Mauro; A., Zupan
Complexes of Diethylenetriaminepentaacetic Acid As Contrast Agents In Nmr Imaging - Computer-simulation of Equilibria In Human Blood-plasma
1990 M. C., Gennaro; S., Aime; E., Santucci; Causa', Mauro; C., Destefano
On the Structural-properties of Nacl - An Abinitio Study of the B1-b2 Phase-transition
1993 E., Apra; Causa', Mauro; M., Prencipe; R., Dovesi; V. R., Saunders
A quantum mechanical study of TiCl3 alpha, beta and gamma crystal phases: geometry, electronic structure and magnetism
2009 L., Sementa; M., D'Amore; V., Barone; Busico, Vincenzo; Causa', Mauro
Structure and ESR features of a radiation-induced radical in alpha-glycine crystals
2008 V., Barone; Causa', Mauro
Hartree-fock Study of Polysulfur Nitride .2. 3-dimensional Structures and Interchain Interactions
1988 Causa', Mauro; R., Dovesi; C., Pisani; C., Roetti; V. R., Saunders
Il ruolo dei metodi ab initio nelllo studio dei materiali
2007 Causa', Mauro; Barone, Vincenzo
Modellizzazione su scala regionale della dinamica e della chimica del particolato atmosferico
2005 Causa', Mauro
Hartree-fock Abinitio Characterization of Ionic-crystal Surfaces With A Slab Model - the (0001) Face of Alpha-al2o3
1987 C., Pisani; Causa', Mauro; R., Dovesi; C., Roetti
Border Reactivity of Polycyclic Aromatic Hydrocarbons and Soot Platelets Toward Ozone. A Theoretical Study
2011 A., Giordana; A., Maranzana; G., Ghigo; Causa', Mauro; G., Tonachini
Maximum Probability Domains in the Solid-State Structures of the Elements: the Diamond Structure
2011 Causa', Mauro; A., Savin
Electrostatic effects on cluster simulation of ionic crystals and surfaces
2008 Causa', Mauro; Vincenzo, Barone; Mauro Stener, Giovanna Fronzoni