Jean-Marc Langlois

Electronic Structure and Valence-Bond Band Structure of Cuprate Superconducting Materials

Yuejin Guo, Jean-Marc Langlois, William A. Goddard · Science · 1988 · 298 citations

Natural Sciences, Materials Science, Physics +17

New pseudospectral algorithms for electronic structure calculations: Length scale separation and analytical two-electron integral corrections

Burnham H. Greeley, Thomas Russo, Daniel T. Mainz et al. · The Journal of Chemical Physics · 1994 · 134 citations

Natural Sciences, Chemistry, Physics +11

Advanced initial-guess algorithm for self-consistent-field calculations on organometallic systems

George Vacek, Jason K. Perry, Jean-Marc Langlois · Chemical Physics Letters · 1999 · 97 citations

Natural Sciences, Chemistry, Materials Science +10

Band structures of II-VI semiconductors using Gaussian basis functions with separable<i>ab initio</i>pseudopotentials: Application to prediction of band offsets

Xiaojie Chen, Xinlei Hua, Jin‐Song Hu et al. · Physical review. B, Condensed matter · 1996 · 49 citations · Full text

Natural Sciences, Materials Science, Physics +17

Quantum mechanical geometry optimization in solution using a finite element continuum electrostatics method

Christian M. Cortis, Jean-Marc Langlois, Michael D. Beachy et al. · The Journal of Chemical Physics · 1996 · 48 citations

Natural Sciences, Chemistry, Computational Chemistry +16