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 TitleAuthors / EditorsDate
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Ab Initio Molecular Dynamics for d-Electron Systems: Liquid Copper at 1500 K Pasquarello, Alfredo; Laasonen, Kari; Car, Roberto; Lee, Changyol; Vanderbilt, David 1992
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Acceptor energy levels in GaAs/AlGaAs quantum wells in the presence of an external magnetic field Zhao, Q.X.; Holtz, P.O.; Pasquarello, Alfredo; Monemar, B.; Willander, M. 1995
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First principles molecular dynamics calculation of the structure and acidity of a bulk zeolite Campana, Luca; Selloni, Annabella; Weber, Jacques; Pasquarello, Alfredo; ... Goursot, Annick 1994
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First-Principles Study of Microscopic Models of the Si(001)-SiO2 interface Pasquarello, Alfredo; Hybertsen, Mark S.; Car, Roberto 1995
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Model of vitreous SiO2 generated by an ab initio molecular-dynamics quench from the melt Sarnthein, Johannes; Pasquarello, Alfredo; Car, Roberto 1995
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Si 2p Core-Level Shifts at the Si(001)-SiO2 Interface: a First-Principles Study Pasquarello, Alfredo; Hybertsen, Mark S.; Car, Roberto 1995
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Structural and Electronic Properties of Liquid and Amorphous SiO2: An Ab Initio Molecular Dynamics Study Sarnthein, Johannes; Pasquarello, Alfredo; Car, Roberto 1995
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Structural and electronic properties of small copper clusters: a first principles study Massobrio, Carlo; Pasquarello, Alfredo; Car, Roberto 1995