Sfoglia per Autore
Elastic constants and electronic structure of fluorine (CaF2): an ab initio Hartree-Fock study
1991 M. Catti, A. Pavese, R. Dovesi, V. Saunders
Quantum mechanical Hartree-Fock self-consistent field study of elastic constants and chemical bonding of MgF2 (sellaite)
1991 M. Catti, A. Pavese, R. Dovesi, C. Roetti, M. Causa
Interatomic potentials for CaCO3 polymorphs (calcite and þaragonite), fitted to elastic and vibrational data
1992 A. Pavese, M. Catti, G.D. Price, R. Jackson
Theoretical equilibrium and growth morphology of anhydrite (CaSO4) crystals
1992 D. Aquilano, M. Rubbo, M. Catti, A. Pavese, P. Ugliengo
Thermodynamic properties of CaCO3 calcite and aragonite: a quasi-harmonic calculation
1993 C. Catti, A. Pavese, G.D. Price
Quantum-mechanical Hartree-Fock study of calcite at variable pressure, and comparison with magnesite
1993 M. Catti, A. Pavese, E. Apra, C. Roetti
Powder neutron diffraction study of 2M1 muscovite at room pressure and at 2 GPa
1994 M. Catti, G. Ferraris, S. Hull, A. Pavese
X-ray single crystal diffraction study of pyrope in the temperature range 30-973 K
1995 A. Pavese, G. Artioli, M. Prencipe
Nature of structural disorder in natural kaolinites : a new model based on computer simulation of powder diffraction data and electrostatic energy calculation
1995 G. Artioli, M. Bellotto, A. Gualtieri, A. Pavese
Static compression and H disorder in Mg(OH)2 (brucite) to 11 GPa : a powder neutron diffraction study
1995 M. Catti, G. Ferraris, S. Hull, A. Pavese
Tungusite: new data, relationship and structural model
1995 G. Ferraris, A. Pavese, S. Soboleva
Mn crystal chemistry in pumpellyite: a resonant-scattering powder diffraction Rietveld study using synchrotron radiation
1996 G. Artioli, A. Pavese, M. Bellotto, S.P. Collins, G. Lucchetti
Quantum mechanical and classical simulations of Mg-Ca carbonates
1996 M. Catti, A. Pavese
Nafertisite, a layer titanosilicate member of a polysomatic series including mica
1996 G. Ferraris, G. Ivaldi, A.P. Khomyakov, S. Soboleva, E. Belluso, A. Pavese
Modelling of the thermal dependence of structural and elastic properties in calcite (CaCO3)
1996 A. Pavese, M. Catti, S. Parker, A. Walls
Dispersion relations of acoustic phonons in pyrope garnet: relationship between vibrational properties and elastic constants
1996 G. Artioli, A. Pavese, O. Moze
Theoretical structure factors and electron density of magnesite (MgCO3)
1996 M. Catti, A. Pavese
Profile-fitting of single crystal diffraction data
1996 A. Pavese, G. Artioli
Cation site ordering in phengite 3T from the Dora-Maira massif (western Alps): a variable-temperature neutron diffraction study
1997 A. Pavese, G. Ferraris, M. Prencipe, R. Ibberson
P-V equation of state of portlandite, Ca(OH)2, from powder neutron diffraction data
1997 A. Pavese, M. Catti, G. Ferraris, S. Hull
Legenda icone
- file ad accesso aperto
- file disponibili sulla rete interna
- file disponibili agli utenti autorizzati
- file disponibili solo agli amministratori
- file sotto embargo
- nessun file disponibile