Year |
Citation |
Score |
2000 |
Topper RQ, Tawa GJ, Truhlar DG. Erratum: “Quantum free-energy calculations: A three-dimensional test case” [J. Chem. Phys. 97, 3668 (1992)] The Journal of Chemical Physics. 113: 3930-3930. DOI: 10.1063/1.1286966 |
0.699 |
|
1998 |
Tawa GJ, Topol IA, Burt SK, Caldwell RA, Rashin AA. Calculation of the aqueous solvation free energy of the proton Journal of Chemical Physics. 109: 4852-4863. DOI: 10.1063/1.477096 |
0.459 |
|
1995 |
Mielke SL, Tawa GJ, Truhlar DG, Schwenke DW. Quantum photochemistry. Accurate quantum scattering calculations for an electronically nonadiabatic reaction Chemical Physics Letters. 234: 57-63. DOI: 10.1016/0009-2614(94)01515-W |
0.69 |
|
1994 |
Tawa GJ, Mielke SL, Truhlar DG, Schwenke DW. Algebraic variational and propagation formalisms for quantal dynamics calculations of electronic‐to‐vibrational, rotational energy transfer and application to the quenching of the 3pstate of sodium by hydrogen molecules The Journal of Chemical Physics. 100: 5751-5777. DOI: 10.1063/1.467140 |
0.725 |
|
1994 |
Tawa GJ, Mielke SL, Truhlar DG, Schwenke DW. Algebraic variational and propagation formalisms for quantal dynamics calculations of electronic-to-vibrational, rotational energy transfer and application to the quenching of the 3p state of sodium by hydrogen molecules The Journal of Chemical Physics. 100: 5751-5777. |
0.652 |
|
1993 |
Mielke SL, Tawa GJ, Truhlar DG, Schwenke DW. Energy transfer through exciplex funnel states Journal of the American Chemical Society. 115: 6436-6437. DOI: 10.1021/Ja00067A079 |
0.672 |
|
1993 |
Schwenke DW, Mielke SL, Tawa GJ, Friedman RS, Halvick P, Truhlar DG. Converged quantum-mechanical calculations of electronic-to-vibrational, rotational energy transfer probabilities in a system with a conical intersection Chemical Physics Letters. 203: 565-572. DOI: 10.1016/0009-2614(93)85311-B |
0.728 |
|
1993 |
Mielke SL, Tawa GJ, Truhlar DG, Schwenke DW. Partial widths of feshbach funnel resonances in the Na(3p) � H2 exciplex International Journal of Quantum Chemistry. 48: 621-632. DOI: 10.1002/Qua.560480856 |
0.626 |
|
1993 |
Mielke SL, Tawa GJ, Truhlar DG, Schwenke DW. Energy transfer through exciplex funnel states Journal of the American Chemical Society. 115: 6436-6437. |
0.651 |
|
1992 |
Tawa GJ, Whitlock P, Schmidt KE, Moskowitz JW. Monte carlo calculation of interaction energies for van der waals complexes Molecular Physics. 77: 477-489. DOI: 10.1080/00268979200102561 |
0.362 |
|
1992 |
Topper RQ, Tawa GJ, Truhlar DG. Quantum free‐energy calculations: A three‐dimensional test case The Journal of Chemical Physics. 97: 3668-3673. DOI: 10.1063/1.462949 |
0.668 |
|
1992 |
Topper RQ, Tawa GJ, Truhlar DG. Quantum free-energy calculations: A three-dimensional test case The Journal of Chemical Physics. 97: 3668-3673. |
0.712 |
|
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