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Results:
1-23
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Results: 23
Authors:
Hahn, DK
Klippenstein, SJ
Miller, JA
Citation: Dk. Hahn et al., A theoretical analysis of the reaction between propargyl and molecular oxygen, FARADAY DIS, 119, 2001, pp. 79-100
Authors:
DeSain, JD
Taatjes, CA
Miller, JA
Klippenstein, SJ
Hahn, DK
Citation: Jd. Desain et al., Infrared frequency-modulation probing of product formation in alkyl plus O-2 reactions - Part IV. Reactions of propyl and butyl radicals with O-2, FARADAY DIS, 119, 2001, pp. 101-120
Authors:
Fang, DC
Harding, LB
Klippenstein, SJ
Miller, JA
Citation: Dc. Fang et al., A direct transition state theory based analysis of the branching in NH2+NO, FARADAY DIS, 119, 2001, pp. 207-222
Authors:
Taatjes, CA
Klippenstein, SJ
Citation: Ca. Taatjes et Sj. Klippenstein, Kinetic isotope effects and variable reaction coordinates in barrierless recombination reactions, J PHYS CH A, 105(37), 2001, pp. 8567-8578
Authors:
Marcy, TP
Diaz, RR
Heard, D
Leone, SR
Harding, LB
Klippenstein, SJ
Citation: Tp. Marcy et al., Theoretical and experimental investigation of the dynamics of the production of CO from the CH3+O and CD3+O reactions, J PHYS CH A, 105(36), 2001, pp. 8361-8369
Authors:
Miller, JA
Klippenstein, SJ
Citation: Ja. Miller et Sj. Klippenstein, The recombination of propargyl radicals: Solving the master equation, J PHYS CH A, 105(30), 2001, pp. 7254-7266
Authors:
Thiesemann, H
Clifford, EP
Taatjes, CA
Klippenstein, SJ
Citation: H. Thiesemann et al., Temperature dependence and deuterium kinetic isotope effects in the CH(CD)+C2H4(C2D4) reaction between 295 and 726 K, J PHYS CH A, 105(22), 2001, pp. 5393-5401
Authors:
Miller, JA
Klippenstein, SJ
Citation: Ja. Miller et Sj. Klippenstein, The reaction between ethyl and molecular oxygen II: Further analysis, INT J CH K, 33(11), 2001, pp. 654-668
Authors:
Forsythe, KM
Gray, SK
Klippenstein, SJ
Hall, GE
Citation: Km. Forsythe et al., An ab initio molecular dynamics study of S-0 ketene fragmentation, J CHEM PHYS, 115(5), 2001, pp. 2134-2145
Authors:
Klippenstein, SJ
Yang, CN
Citation: Sj. Klippenstein et Cn. Yang, Density functional theory predictions for the binding of transition metal cations to pi systems: from acetylene to coronene and tribenzocyclyne, INT J MASS, 201(1-3), 2000, pp. 253-267
Authors:
Miller, JA
Klippenstein, SJ
Robertson, SH
Citation: Ja. Miller et al., A theoretical analysis of the reaction between vinyl and acetylene: Quantum chemistry and solution of the master equation (vol 104, pg 7527, 2000), J PHYS CH A, 104(43), 2000, pp. 9806-9806
Authors:
Miller, JA
Klippenstein, SJ
Robertson, SH
Citation: Ja. Miller et al., A theoretical analysis of the reaction between vinyl and acetylene: Quantum chemistry and solution of the master equation, J PHYS CH A, 104(32), 2000, pp. 7525-7536
Authors:
Gapeev, A
Yang, CN
Klippenstein, SJ
Dunbar, RC
Citation: A. Gapeev et al., Binding energies of gas-phase metal ions with pyrrole: Experimental and quantum chemical results, J PHYS CH A, 104(14), 2000, pp. 3246-3256
A summary of "A direct transition state theory based study of methyl radical recombination kinetics"
Authors:
Klippenstein, SJ
Harding, LB
Citation: Sj. Klippenstein et Lb. Harding, A summary of "A direct transition state theory based study of methyl radical recombination kinetics", J PHYS CH A, 104(11), 2000, pp. 2351-2354
Authors:
Miller, JA
Klippenstein, SJ
Citation: Ja. Miller et Sj. Klippenstein, Theoretical considerations in the NH2+NOreaction, J PHYS CH A, 104(10), 2000, pp. 2061-2069
Authors:
Urnezius, E
Klippenstein, SJ
Protasiewicz, JD
Citation: E. Urnezius et al., Sterically promoted zirconium-phosphorus pi-bonding: structural investigations of [Cp2Zr(Cl){P(H)Dmp}] and [Cp2Zr{P(H)Dmp}(2)] (Dmp=2,6-Mes(2)C(6)H(3)), INORG CHIM, 297(1-2), 2000, pp. 181-190
Authors:
Klippenstein, SJ
Harding, LB
Citation: Sj. Klippenstein et Lb. Harding, A theoretical study of the kinetics of C2H3+H, PCCP PHYS C, 1(6), 1999, pp. 989-997
Authors:
Ryzhov, V
Yang, CN
Klippenstein, SJ
Dunbar, RC
Citation: V. Ryzhov et al., Binding energies of chromium cations with fluorobenzenes from radiative association kinetics, INT J MASS, 187, 1999, pp. 913-923
Authors:
Yang, CN
Klippenstein, SJ
Citation: Cn. Yang et Sj. Klippenstein, Theory and modeling of the binding in cationic transition-metal-benzene complexes, J PHYS CH A, 103(8), 1999, pp. 1094-1103
Authors:
Klippenstein, SJ
Harding, LB
Citation: Sj. Klippenstein et Lb. Harding, A direct transition state theory based study of methyl radical recombination kinetics, J PHYS CH A, 103(47), 1999, pp. 9388-9398
Authors:
Miller, JA
Klippenstein, SJ
Citation: Ja. Miller et Sj. Klippenstein, Angular momentum conservation in the O+OH <-> O-2+H reaction, INT J CH K, 31(10), 1999, pp. 753-756
Authors:
Cui, Q
Morokuma, K
Bowman, JM
Klippenstein, SJ
Citation: Q. Cui et al., The spin-forbidden reaction CH((2)Pi)+N-2 -> HCN+N(S-4) revisited. II. Nonadiabatic transition state theory and application, J CHEM PHYS, 110(19), 1999, pp. 9469-9482
Authors:
Sawilowsky, EF
Klippenstein, SJ
Citation: Ef. Sawilowsky et Sj. Klippenstein, Transition-state theory based modeling of the dynamics of the O+(S-4)+CO2 reaction, J PHYS CH A, 102(48), 1998, pp. 9811-9818
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