| 1461 |
|
Ab initio investigations on neutral clusters of ammonia: (NH3)n (n=2-6)
|
Kulkarni, Sudhir A
|
|
2001
|
|
|
|
| 1462 |
|
Ab initio investigations on neutral hydrogen peroxide clusters: (H2O2)n (n=2-4)
|
Kulkarni, S. A
|
North Holland
|
2003
|
|
|
|
| 1463 |
|
Ab initio lattice dynamics of metal surfaces
|
Heid, R
|
North-Holland Pub. Co
|
2003
|
|
|
|
| 1464 |
|
Ab initio local-spin-density study of the structural and magnetic properties of La1-xCaxMnO3 systems/
|
Lorenz, R
|
North-Holland Pub. Co
|
2001
|
|
|
|
| 1465 |
|
Ab initio MO calculations of hyperfine coupling constants of hydronium radical H3O/
|
Tachikawa, Hiroto
|
North Holland
|
2001
|
|
|
|
| 1466 |
|
Ab initio modeling of boron clustering in silicon/
|
Liu, Xiang-Yang
|
American Institute of Physics
|
2000
|
|
|
|
| 1467 |
|
Ab initio modeling of quantum transport properties of molecular electronic devices (13 pages)/
|
Taylor, Jeremy
|
|
2001
|
|
|
|
| 1468 |
|
Ab Initio Modeling of Small, Medium, and Large Loops in Proteins/
|
Galaktionov, S
|
John Wiley & Sons, etc.]
|
2001
|
|
|
|
| 1469 |
|
Ab initio modeling of surface structure for SrTiO3 perovskite crystals (5 pages)/
|
Heifets, E
|
Published for the American Physical Society by the American Institute of Physics
|
2001
|
|
|
|
| 1470 |
|
Ab initio model study on a water molecule between graphite layers/
|
Ruuska, H
|
Pergamon Press
|
2003
|
|
|
|
| 1471 |
|
Ab initio molecular dynamics around a conical intersection: Li(2p) + H~2
|
Martinez, T. J.
|
North Holland
|
1997
|
|
|
|
| 1472 |
|
Ab initio molecular dynamics for liquid metals
|
Kresse, G
|
North-Holland
|
1980
|
|
|
|
| 1473 |
|
Ab initio molecular dynamics of ion solvation. The case of Be^2^+ in water
|
Sprik, M. Marx, D. Parrinello, M.
|
North Holland
|
1997
|
|
|
|
| 1474 |
|
Ab initio molecular dynamics of pseudorotating Li~5
|
Carter, E. A. Gibson, D. A.
|
North Holland
|
1997
|
|
|
|
| 1475 |
|
Ab initio molecular dynamics of retinals
|
De Groot, H. J. M. Bifone, A. Buda, F.
|
North Holland
|
1996
|
|
|
|
| 1476 |
|
Ab initio Molecular Dynamics Simulation of Laser Melting of Silicon
|
Silvestrelli, P. L
|
American Physical Society
|
1980
|
|
|
|
| 1477 |
|
Ab initio molecular-dynamics simulation of liquid GaxAs1-x alloys/
|
Kulkarni, R V
|
Published for the American Physical Society by the American Institute of Physics
|
2000
|
|
|
|
| 1478 |
|
Ab initio molecular dynamics simulation of liquid hydrogen fluoride
|
Roethlisberger, U
|
American Institute of Physics
|
1980
|
|
|
|
| 1479 |
|
Ab initio molecular dynamics simulation of liquid water: Comparison of three gradient-corrected density functionals
|
Sprik, M
|
American Institute of Physics
|
1980
|
|
|
|
| 1480 |
|
Ab initio molecular dynamics simulation of methanol adsorbed in chabazite
|
Sauer, J. Hutter, J. Haase, F.
|
North Holland
|
1997
|
|
|
|