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Lawrence Harding
Lawrence Harding
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The roaming atom: straying from the reaction path in formaldehyde decomposition
D Townsend, SA Lahankar, SK Lee, SD Chambreau, AG Suits, X Zhang, ...
Science 306 (5699), 1158-1161, 2004
6432004
On the enthalpy of formation of hydroxyl radical and gas-phase bond dissociation energies of water and hydroxyl
B Ruscic, AF Wagner, LB Harding, RL Asher, D Feller, DA Dixon, ...
The Journal of Physical Chemistry A 106 (11), 2727-2747, 2002
5322002
The role of NNH in NO formation and control
SJ Klippenstein, LB Harding, P Glarborg, JA Miller
Combustion and Flame 158 (4), 774-789, 2011
3952011
The description of chemical bonding from ab initio calculations
WA Goddard III, LB Harding
Annual Review of Physical Chemistry 29 (1), 363-396, 1978
3291978
A binitio calculations of electronic and vibrational energies of HCO and HOC
JM Bowman, JS Bittman, LB Harding
The Journal of chemical physics 85 (2), 911-921, 1986
2591986
Predictive theory for the combination kinetics of two alkyl radicals
SJ Klippenstein, Y Georgievskii, LB Harding
Physical Chemistry Chemical Physics 8 (10), 1133-1147, 2006
2472006
Kinetics of the reaction of methyl radical with hydroxyl radical and methanol decomposition
AW Jasper, SJ Klippenstein, LB Harding, B Ruscic
The Journal of Physical Chemistry A 111 (19), 3932-3950, 2007
2442007
The mechanism of the ene reaction of singlet oxygen with olefins
LB Harding, WA Goddard III
Journal of the American Chemical Society 102 (2), 439-449, 1980
236*1980
Vibrational energy levels of formaldehyde
H Romanowski, JM Bowman, LB Harding
The Journal of chemical physics 82 (9), 4155-4165, 1985
2321985
Predictive theory for hydrogen atom− hydrocarbon radical association kinetics
LB Harding, Y Georgievskii, SJ Klippenstein
The Journal of Physical Chemistry A 109 (21), 4646-4656, 2005
2302005
Mechanisms of gas-phase and liquid-phase ozonolysis
LB Harding, WA Goddard III
Journal of the American Chemical Society 100 (23), 7180-7188, 1978
2231978
State-to-state chemistry with fast hydrogen atoms. Reaction and collisional excitation in H+ CO 2
GC Schatz, MS Fitzcharles, LB Harding
Faraday Discussions of the Chemical Society 84, 359-369, 1987
2221987
A global H2O potential energy surface for the reaction O (1D)+ H2→ OH+ H
TS Ho, T Hollebeek, H Rabitz, LB Harding, GC Schatz
The Journal of chemical physics 105 (23), 10472-10486, 1996
2171996
Evidence for a lower enthalpy of formation of hydroxyl radical and a lower gas-phase bond dissociation energy of water
B Ruscic, D Feller, DA Dixon, KA Peterson, LB Harding, RL Asher, ...
The Journal of Physical Chemistry A 105 (1), 1-4, 2001
2002001
Rate constants for the thermal decomposition of ethanol and its bimolecular reactions with OH and D: reflected shock tube and theoretical studies
R Sivaramakrishnan, MC Su, JV Michael, SJ Klippenstein, LB Harding, ...
The Journal of Physical Chemistry A 114 (35), 9425-9439, 2010
1862010
Uncertainty driven theoretical kinetics studies for CH3OH ignition: HO2+ CH3OH and O2+ CH3OH
SJ Klippenstein, LB Harding, MJ Davis, AS Tomlin, RT Skodje
Proceedings of the Combustion Institute 33 (1), 351-357, 2011
1812011
Ab initio methods for reactive potential surfaces
LB Harding, SJ Klippenstein, AW Jasper
Physical Chemistry Chemical Physics 9 (31), 4055-4070, 2007
1802007
Potential energy surface and quasiclassical trajectory studies of the CN+ H2 reaction
MA Ter Horst, GC Schatz, LB Harding
The Journal of chemical physics 105 (2), 558-571, 1996
1781996
Initiation in H2/O2: Rate constants for H2+ O2→ H+ HO2 at high temperature
JV Michael, JW Sutherland, LB Harding, AF Wagner
Proceedings of the Combustion Institute 28 (2), 1471-1478, 2000
1762000
Ab initio computations and active thermochemical tables hand in hand: Heats of formation of core combustion species
SJ Klippenstein, LB Harding, B Ruscic
The Journal of Physical Chemistry A 121 (35), 6580-6602, 2017
1692017
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Artiklar 1–20