Efficient pseudopotentials for plane-wave calculations N Troullier, JL Martins
Physical review B 43 (3), 1993, 1991
18563 1991 Electronic structure of solid : Experiment and theory JH Weaver, JL Martins, T Komeda, Y Chen, TR Ohno, GH Kroll, ...
Physical review letters 66 (13), 1741, 1991
692 1991 A straightforward method for generating soft transferable pseudopotentials N Troullier, JL Martins
Solid State Communications 74 (7), 613-616, 1990
560 1990 Bond lengths around isovalent impurities and in semiconductor solid solutions JL Martins, A Zunger
Physical Review B 30 (10), 6217, 1984
510 1984 Electronic and structural properties of sodium clusters JL Martins, J Buttet, R Car
Physical Review B 31 (4), 1804, 1985
467 1985 Atomic structure and ordering in semiconductor alloys GP Srivastava, JL Martins, A Zunger
Physical Review B 31 (4), 2561, 1985
445 1985 Ab initio molecular dynamics with variable cell shape: application to MgSiO 3 RM Wentzcovitch, JL Martins, GD Price
Physical Review Letters 70 (25), 3947, 1993
380 1993 Efficient pseudopotentials for plane-wave calculations. II. Operators for fast iterative diagonalization N Troullier, JL Martins
Physical Review B 43 (11), 8861, 1991
372 1991 Structural and electronic properties of N Troullier, JL Martins
Physical Review B 46 (3), 1754, 1992
349 1992 Electronic States of Kx C60 : Insulating, Metallic, and Superconducting Character PJ Benning, JL Martins, JH Weaver, LPF Chibante, RE Smalley
Science 252 (5011), 1417-1419, 1991
320 1991 Stability of ordered bulk and epitaxial semiconductor alloys JL Martins, A Zunger
Physical review letters 56 (13), 1400, 1986
290 1986 Energetics of interplanar binding in graphite MC Schabel, JL Martins
Physical review B 46 (11), 7185, 1992
253 1992 Variational spherical model of small metallic particles JL Martins, R Car, J Buttet
Surface science 106 (1-3), 265-271, 1981
225 1981 Energy versus free-energy conservation in first-principles molecular dynamics RM Wentzcovitch, JL Martins, PB Allen
Physical Review B 45 (19), 11372, 1992
216 1992 Electronic properties of alkali trimers JL Martins, R Car, J Buttet
The Journal of Chemical Physics 78 (9), 5646-5655, 1983
212 1983 Theory of high-pressure phases of hydrogen TW Barbee III, ML Cohen, JL Martins
Physical review letters 62 (10), 1150, 1989
187 1989 Band dispersion and empty electronic states in solid : Inverse photoemission and theory MB Jost, N Troullier, DM Poirier, JL Martins, JH Weaver, LPF Chibante, ...
Physical Review B 44 (4), 1966, 1991
168 1991 Pseudopotential plane-wave calculations for ZnS JL Martins, N Troullier, SH Wei
Physical Review B 43 (3), 2213, 1991
168 1991 Analysis of occupied and empty electronic states of C60 JL Martins, N Troullier, JH Weaver
Chemical physics letters 180 (5), 457-460, 1991
166 1991 Electronic states of solid C 60: Symmetries and photoionization cross sections PJ Benning, DM Poirier, N Troullier, JL Martins, JH Weaver, RE Haufler, ...
Physical Review B 44 (4), 1962, 1991
160 1991