1 |
Time-dependent self-consistent-field dynamics based on a reaction path Hamiltonian. I. Theory Fang JY, Hammes-Schiffer S Journal of Chemical Physics, 108(17), 7085, 1998 |
2 |
Density pair correlation functions for molecular liquids: Approximations for polymers Donley JP, Rajasekaran JJ, Liu AJ Journal of Chemical Physics, 109(23), 10499, 1998 |
3 |
C6H5Br+center dot -> C6H5++Br-center dot occurs via orbiting transition state Lim SH, Choe JC, Kim MS Journal of Physical Chemistry A, 102(38), 7375, 1998 |
4 |
The Ordering of Symmetrical Diblock Copolymers - A Comparison of Self-Consistent-Field and Density-Functional Approaches Nath SK, Mccoy JD, Curro JG, Saunders RS Journal of Chemical Physics, 106(5), 1950, 1997 |
5 |
Quantum Simulations of Energy-Transfer and State-to-State Transitions in Collision of an Atom with a Large Anharmonic Cluster - He+ar-13 Rom AY, Gerber RB Journal of Chemical Physics, 106(24), 10168, 1997 |
6 |
On the Control of Surface Enrichment in Polymer Blends and Copolymers Donley JP, Wu DT, Fredrickson GH Macromolecules, 30(7), 2167, 1997 |
7 |
Isomer Specific Evaporation Rates - The Case of Aniline-Ar-2 Parneix P, Brechignac P, Amar FG Journal of Chemical Physics, 104(3), 983, 1996 |
8 |
Reaction-Path Hamiltonian Based on a Reaction Coordinate and a Curvature Coordinate Taketsugu T, Gordon MS Journal of Chemical Physics, 104(8), 2834, 1996 |
9 |
Reaction Dynamics of the 4-Centered Elimination Ch2Oh+-)Cho++h-2 - Measurement of Kinetic-Energy Release Distribution and Classical Trajectory Calculation Lee TG, Park SC, Kim MS Journal of Chemical Physics, 104(12), 4517, 1996 |
10 |
Nonlinear Terms Due to Many-Particle Correlation in the Density-Functional Theory Yoshimori A Journal of Chemical Physics, 104(23), 9586, 1996 |