검색결과 : 13건
| No. | Article |
|---|---|
| 1 |
Finite-temperature effects on the stability and infrared spectra of HCl(H2O)(6) clusters Ndongmouo UFT, Lee MS, Rousseau R, Baletto F, Scandolo S Journal of Physical Chemistry A, 111(49), 12810, 2007 |
| 2 |
Interfacial electrostatics of self-assembled monolayers of alkane thiolates on Au(111): Work function modification and molecular level alignments Rousseau R, De Renzi V, Mazzarello R, Marchetto D, Biagi R, Scandolo S, del Pennino U Journal of Physical Chemistry B, 110(22), 10862, 2006 |
| 3 |
Thermal conductivity of solid argon from molecular dynamics simulations Tretiakov KV, Scandolo S Journal of Chemical Physics, 120(8), 3765, 2004 |
| 4 |
Trapping of excitons at chemical defects in polyethylene Ceresoli D, Tosatti E, Scandolo S, Santoro G, Serra S Journal of Chemical Physics, 121(13), 6478, 2004 |
| 5 |
Thermal conductivity of solid argon at high pressure and high temperature: A molecular dynamics study Tretiakov KV, Scandolo S Journal of Chemical Physics, 121(22), 11177, 2004 |
| 6 |
Electronic properties of metal-molecule-metal systems at zero bias: A periodic density functional study Piccinin S, Selloni A, Scandolo S, Car R, Scoles G Journal of Chemical Physics, 119(13), 6729, 2003 |
| 7 |
A many-body interatomic potential for ionic systems: Application to MgO Tangney P, Scandolo S Journal of Chemical Physics, 119(18), 9673, 2003 |
| 8 |
Self-trapping vs. non-trapping of electrons and holes in organic insulators: polyethylene Serra S, Iarlori S, Tosatti E, Scandolo S, Righi MC, Santoro GE Chemical Physics Letters, 360(5-6), 487, 2002 |
| 9 |
How well do Car-Parrinello simulations reproduce the Born-Oppenheimer surface? Theory and examples Tangney P, Scandolo S Journal of Chemical Physics, 116(1), 14, 2002 |
| 10 |
An ab initio parametrized interatomic force field for silica Tangney P, Scandolo S Journal of Chemical Physics, 117(19), 8898, 2002 |