Authors:
Fontana, G
Causa, M
Gianotti, V
Marchionni, G
Citation: G. Fontana et al., Computational studies of the reaction of the hydroxyl radical with hydrofluorocarbons (HFCs) and hydrofluoroethers (HFEs), J FLUORINE, 109(2), 2001, pp. 113-121
Authors:
Lee, KH
Causa, M
Park, SS
Lee, C
Suh, Y
Eun, HM
Kim, D
Citation: Kh. Lee et al., Interpretation of scanning probe microscope image of the structure of atomic vacancy on graphite: ab initio periodic Hartree-Fock calculations, J MOL ST-TH, 506, 2000, pp. 297-301
Citation: R. Pandey et al., A theoretical study of stability, electronic, and optical properties of GeC and SnC, J APPL PHYS, 88(11), 2000, pp. 6462-6466
Authors:
Pisani, C
Dovesi, R
Roetti, C
Causa, M
Orlando, R
Casassa, S
Saunders, VR
Citation: C. Pisani et al., CRYSTAL and EMBED, two computational tools for the ab initio study of electronic properties of crystals, INT J QUANT, 77(6), 2000, pp. 1032-1048
Citation: A. Kokalj et al., Periodic DFT study of the Pt(111): A p(1x1) atomic oxygen interaction withthe surface, J PHYS CH B, 103(34), 1999, pp. 7222-7232
Authors:
Marchese, L
Frache, A
Gianotti, E
Martra, G
Causa, M
Coluccia, S
Citation: L. Marchese et al., ALPO-34 and SAPO-34 synthesized by using morpholine as templating agent. FTIR and FT-Raman studies of the host-guest and guest-guest interactions within the zeolitic framework, MICROP M M, 30(1), 1999, pp. 145-153
Citation: A. Kokalj et M. Causa, Periodic density functional theory study of Pt(111): surface features of slabs of different thicknesses, J PHYS-COND, 11(39), 1999, pp. 7463-7480
Authors:
Radice, S
Tortelli, V
Causa, M
Castiglioni, C
Zerbi, G
Citation: S. Radice et al., Quantum mechanical calculations and spectroscopic analysis of fluorinated vinyl ether molecules, J FLUORINE, 95(1-2), 1999, pp. 105-116
Citation: R. Pandey et al., First-principles study of stability, band structure, and optical properties of the ordered Ge0.50Sn0.50 alloy, APPL PHYS L, 75(26), 1999, pp. 4127-4129
Authors:
Baraille, I
Pouchan, C
Causa, M
Marinelli, F
Citation: I. Baraille et al., Comparison between Hartree-Fock and Kohn-Sham electronic and structural properties for hexagonal-close-packed magnesium, J PHYS-COND, 10(48), 1998, pp. 10969-10977