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Results: 22
Role of defects in the electronic properties of amorphous/crystalline Si interface - art. no. 193303
Authors:
Peressi, M
Colombo, L
de Gironcoli, S
Citation: M. Peressi et al., Role of defects in the electronic properties of amorphous/crystalline Si interface - art. no. 193303, PHYS REV B, 6419(19), 2001, pp. 3303
Authors:
Ismail,"Plummer, EW
Lazzeri, M
de Gironcoli, S
Citation: Ew. Ismail,"plummer et al., Surface oscillatory thermal expansion: Mg(10(1)over-bar0) - art. no. 233401, PHYS REV B, 6323(23), 2001, pp. 3401
Authors:
Satta, A
de Gironcoli, S
Citation: A. Satta et S. De Gironcoli, Surface structure and core-level shifts in lead chalcogenide (001) surfaces - art. no. 033302, PHYS REV B, 6303(3), 2001, pp. 3302
Authors:
Karki, BB
Wentzcovitch, RM
de Gironcoli, S
Baroni, S
Citation: Bb. Karki et al., First principles thermoelasticity of MgSiO3-perovskite: consequences for the inferred properties of the lower mantle, GEOPHYS R L, 28(14), 2001, pp. 2699-2702
Authors:
Baroni, S
de Gironcoli, S
Dal Corso, A
Giannozzi, P
Citation: S. Baroni et al., Phonons and related crystal properties from density-functional perturbation theory, REV M PHYS, 73(2), 2001, pp. 515-562
Authors:
Peressi, M
Fornari, M
de Gironcoli, S
De Santis, L
Baldereschi, A
Citation: M. Peressi et al., Coordination defects in amorphous silicon and hydrogenated amorphous silicon: a characterization from first-principles calculations, PHIL MAG B, 80(4), 2000, pp. 515-521
Authors:
Karki, BB
Wentzcovitch, RM
de Gironcoli, S
Baroni, S
Citation: Bb. Karki et al., High-pressure lattice dynamics and thermoelasticity of MgO, PHYS REV B, 61(13), 2000, pp. 8793-8800
Authors:
Karki, BB
Wentzcovitch, RM
de Gironcoli, S
Baroni, S
Citation: Bb. Karki et al., Ab initio lattice dynamics of MgSiO3 perovskite at high pressure, PHYS REV B, 62(22), 2000, pp. 14750-14756
Authors:
Lichtenstein, AI
Jones, RO
de Gironcoli, S
Baroni, S
Citation: Ai. Lichtenstein et al., Anisotropic thermal expansion in silicates: A density functional study of beta-eucryptite and related materials, PHYS REV B, 62(17), 2000, pp. 11487-11493
Authors:
Dal Corso, A
de Gironcoli, S
Citation: A. Dal Corso et S. De Gironcoli, Ab initio phonon dispersions of Fe and Ni, PHYS REV B, 62(1), 2000, pp. 273-277
Authors:
de Gironcoli, S
Scandolo, S
Ballabio, G
Santoro, G
Tosatti, E
Citation: S. De Gironcoli et al., The mechanism for the 3 x 3 distortion of Sn/Ge(111), SURF SCI, 454, 2000, pp. 172-177
Authors:
Lazzeri, M
de Gironcoli, S
Citation: M. Lazzeri et S. De Gironcoli, Ab initio study of Be (1010) surface dynamical properties, SURF SCI, 454, 2000, pp. 442-446
Authors:
Wentzcovitch, RM
de Gironcoli, S
Baroni, S
Citation: Rm. Wentzcovitch et al., First-principles determination of elastic anisotropy and wave velocities of MgO at lower mantle conditions (vol 287, pg 1705, 1999), SCIENCE, 287(5450), 2000, pp. 43-43
Authors:
Bungaro, C
de Gironcoli, S
Citation: C. Bungaro et S. De Gironcoli, Ab initio study of phonons in wurtzite AlxGa1-xN alloys, APPL PHYS L, 76(15), 2000, pp. 2101-2103
Authors:
Xie, JJ
Chen, SP
de Gironcoli, S
Baroni, S
Citation: Jj. Xie et al., Thermodynamic properties and lattice dynamics of silver at high pressure: a first-principles study, PHIL MAG B, 79(6), 1999, pp. 911-919
Authors:
Xie, JJ
Chen, SP
Tse, JS
de Gironcoli, S
Baroni, S
Citation: Jj. Xie et al., High-pressure thermal expansion, bulk modulus, and phonon structure of diamond, PHYS REV B, 60(13), 1999, pp. 9444-9449
Authors:
Satta, A
Willaime, F
de Gironcoli, S
Citation: A. Satta et al., First-principles study of vacancy formation and migration energies in tantalum, PHYS REV B, 60(10), 1999, pp. 7001-7005
Authors:
Xie, JJ
de Gironcoli, S
Baroni, S
Scheffler, M
Citation: Jj. Xie et al., First-principles calculation of the thermal properties of silver, PHYS REV B, 59(2), 1999, pp. 965-969
Authors:
Xie, JJ
de Gironcoli, S
Baroni, S
Scheffler, M
Citation: Jj. Xie et al., Temperature-dependent surface relaxations of Ag(111), PHYS REV B, 59(2), 1999, pp. 970-974
Authors:
Alfe, D
de Gironcoli, S
Baroni, S
Citation: D. Alfe et al., The reconstruction of nickel and rhodium (001) surfaces upon carbon, nitrogen or oxygen adsorptions, SURF SCI, 437(1-2), 1999, pp. 18-28
Authors:
Karki, BB
Wentzcovitch, RM
de Gironcoli, S
Baroni, S
Citation: Bb. Karki et al., First-principles determination of elastic anisotropy and wave velocities of MgO at lower mantle conditions, SCIENCE, 286(5445), 1999, pp. 1705-1707
Authors:
Kohanoff, J
Scandolo, S
de Gironcoli, S
Tosatti, E
Citation: J. Kohanoff et al., Dipole-quadrupole interactions and the nature of phase III of compressed hydrogen, PHYS REV L, 83(20), 1999, pp. 4097-4100
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