Pseudopotentials that work: From H to Pu GB Bachelet, DR Hamann, M Schlüter Physical Review B 26 (8), 4199, 1982 | 4458 | 1982 |
Correlation energy and spin polarization in the 2D electron gas C Attaccalite, S Moroni, P Gori-Giorgi, GB Bachelet Physical review letters 88 (25), 256601, 2002 | 568 | 2002 |
Relativistic and core-relaxation effects on the energy bands of gallium arsenide and germanium GB Bachelet, NE Christensen Physical Review B 31 (2), 879, 1985 | 364 | 1985 |
Relativistic norm-conserving pseudopotentials GB Bachelet, M Schlüter Physical Review B 25 (4), 2103, 1982 | 316 | 1982 |
Structural-energy calculations based on norm-conserving pseudopotentials and localized Gaussian orbitals GB Bachelet, HS Greenside, GA Baraff, M Schlüter Physical Review B 24 (8), 4745, 1981 | 204 | 1981 |
Total-energy gradients and lattice distortions at point defects in semiconductors M Scheffler, JP Vigneron, GB Bachelet Physical Review B 31 (10), 6541, 1985 | 177 | 1985 |
Analytic static structure factors and pair-correlation functions for the unpolarized homogeneous electron gas P Gori-Giorgi, F Sacchetti, GB Bachelet Physical Review B 61 (11), 7353, 2000 | 159 | 2000 |
Defects in diamond: The unrelaxed vacancy and substitutional nitrogen GB Bachelet, GA Baraff, M Schlüter Physical Review B 24 (8), 4736, 1981 | 147 | 1981 |
Local-spin-density functional for multideterminant density functional theory S Paziani, S Moroni, P Gori-Giorgi, GB Bachelet Physical Review B 73 (15), 155111, 2006 | 130 | 2006 |
Novel pseudo-Hamiltonian for quantum Monte Carlo simulations GB Bachelet, DM Ceperley, MGB Chiocchetti Physical review letters 62 (18), 2088, 1989 | 129 | 1989 |
Superconductivity in sodalite-like yttrium hydride clathrates C Heil, S Di Cataldo, GB Bachelet, L Boeri Physical Review B 99 (22), 220502, 2019 | 124 | 2019 |
antisite defect in GaAs GB Bachelet, M Schlüter, GA Baraff Physical Review B 27 (4), 2545, 1983 | 97 | 1983 |
Electron-phonon interaction in graphite intercalation compounds L Boeri, GB Bachelet, M Giantomassi, OK Andersen Physical Review B 76 (6), 064510, 2007 | 81 | 2007 |
Self-consistent calculations of the electronic structure for ideal Ga and As vacancies in GaAs GB Bachelet, GA Baraff, M Schlüter Physical Review B 24 (2), 915, 1981 | 81 | 1981 |
Small Fermi energy and phonon anharmonicity in and related compounds L Boeri, GB Bachelet, E Cappelluti, L Pietronero Physical Review B 65 (21), 214501, 2002 | 69 | 2002 |
Electrons and phonons in the ternary alloy CaAl 2− x Si x as a function of composition M Giantomassi, L Boeri, GB Bachelet Physical Review B 72 (22), 224512, 2005 | 68 | 2005 |
Pair-distribution functions of the two-dimensional electron gas P Gori-Giorgi, S Moroni, GB Bachelet Physical Review B 70 (11), 115102, 2004 | 63 | 2004 |
Tractable Approach for Calculating Lattice Distortions around Simple Defects in Semiconductors: Application to the Single Donor Ge in GaP M Scheffler, JP Vigneron, GB Bachelet Physical Review Letters 49 (24), 1765, 1982 | 62 | 1982 |
Structural determination of Cl chemisorption on Si {111} and Ge {111} by total-energy minimization GB Bachelet, M Schlüter Physical Review B 28 (4), 2302, 1983 | 58 | 1983 |
Pseudojellium model with an application to lithium clusters L Serra, GB Bachelet, N Van Giai, E Lipparini Physical Review B 48 (19), 14708, 1993 | 47 | 1993 |