David Joseph Mann - Publications
Affiliations: | 2001 | Wayne State University, Detroit, MI, United States |
Year | Citation | Score | |||
---|---|---|---|---|---|
2010 | Mann DJ. Aziridinium ion ring formation from nitrogen mustards: mechanistic insights from ab initio dynamics. The Journal of Physical Chemistry. A. 114: 4486-93. PMID 20222705 DOI: 10.1021/Jp9079553 | 0.378 | |||
2003 | Mann DJ, Halls MD. Water alignment and proton conduction inside carbon nanotubes. Physical Review Letters. 90: 195503. PMID 12785955 DOI: 10.1103/Physrevlett.90.195503 | 0.306 | |||
2002 | Mann DJ, Hase WL. Ab initio direct dynamics study of cyclopropyl radical ring-opening. Journal of the American Chemical Society. 124: 3208-9. PMID 11916395 DOI: 10.1021/Ja017343X | 0.492 | |||
2002 | Mann DJ, Halls MD. Ab initio simulations of oxygen atom insertion and substitutional doping of carbon nanotubes Journal of Chemical Physics. 116: 9014-9020. DOI: 10.1063/1.1470494 | 0.348 | |||
2002 | Mann DJ, Halls MD. Ring-opening of the cyclopropyl radical in the condensed phase: A combined density functional theory/molecular mechanics quasiclassical trajectory study Physical Chemistry Chemical Physics. 4: 5066-5071. DOI: 10.1039/B206365D | 0.332 | |||
2002 | Xie H, Song K, Mann DJ, Hase WL. Temperature gradients and frictional energy dissipation in the sliding of hydroxylated α-alumina surfaces Physical Chemistry Chemical Physics. 4: 5377-5385. DOI: 10.1039/B204698A | 0.491 | |||
2002 | Mann DJ, Halls MD, Hase WL. Direct dynamics studies of CO-assisted carbon nanotube growth Journal of Physical Chemistry B. 106: 12418-12425. DOI: 10.1021/Jp0255435 | 0.464 | |||
2001 | Mann DJ, Hase WL. Direct dynamics simulations of the oxidation of a single wall carbon nanotube Physical Chemistry Chemical Physics. 3: 4376-4383. DOI: 10.1039/B103762P | 0.503 | |||
2001 | Mann DJ, Zhong L, Hase WL. Effect of surface stiffness on the friction of sliding model hydroxylated α-alumina surfaces Journal of Physical Chemistry B. 105: 12032-12045. DOI: 10.1021/Jp010759C | 0.48 | |||
1999 | Mann DJ, Hase WL. Tribology Letters. 7: 153-159. DOI: 10.1023/A:1019121420468 | 0.522 | |||
1998 | Mann DJ, Hase WL. Trajectory Studies of SN2 Nucleophilic Substitution. 6. Translational Activation of the Cl-+ CH3Cl Reaction The Journal of Physical Chemistry A. 102: 6208-6214. DOI: 10.1021/Jp9813591 | 0.495 | |||
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