Found 23 Results | Science History Institute

178. Lester, W.A., Jr., “Research Developments and Progress During the Nineties,” Journal of Molecular Structure (Theochem) 573 (2001): 55-62., 2001

File — Box: 58, Folder: 12

Dates: 2001

Found in: Science History Institute Archives / William A. Lester, Jr. Papers / Series VIII. Publication and Presentation Files / Sub-series 1. Numerical Publication Files

179. Krokidis, X., N.W. Moriarty, W.A. Lester, Jr., and M. Frenklach, “A Quantum Monte Carlo Study of Energy Differences in C4H3 and C4H5 Isomers,” International Journal of Chemical Kinetics 33 (2001): 808-820., 2001

File — Box: 58, Folder: 13

Dates: 2001

Found in: Science History Institute Archives / William A. Lester, Jr. Papers / Series VIII. Publication and Presentation Files / Sub-series 1. Numerical Publication Files

180. Almeida, A.L., J.B.L. Martins, E. Longo, N.C. Furtado, C.A. Taft, J.R. Sambrano, and W.A. Lester, Jr., “Theoretical Study of MgO(001) Surfaces: Pure, Doped with Fe, Ca, and Al, and with and without Absorbed Water,” International Journal of Quantum Chemistry 84 (2001): 705-713., 2000

File — Box: 58, Folder: 14

Dates: 2000

Found in: Science History Institute Archives / William A. Lester, Jr. Papers / Series VIII. Publication and Presentation Files / Sub-series 1. Numerical Publication Files

181. Xiao, C., F. Hagelberg, and W.A. Lester, Jr., “Geometric, Energetic, and Bonding Properties of Neutral and Charged Copper-Doped Silicon Clusters,” Physical Review B 66 (2002): 075425-1-075425-23., 2002

File — Box: 58, Folder: 15

Dates: 2002

Found in: Science History Institute Archives / William A. Lester, Jr. Papers / Series VIII. Publication and Presentation Files / Sub-series 1. Numerical Publication Files

182. Lester, W.A., Jr., and J.C. Grossman, “Quantum Monte Carlo for the Electronic Structure of Combustion Systems.” In Recent Advances in Quantum Monte Carlo Methods - Part II, edited by W.A, Lester, Jr., S. Rothstein, and S. Tanaka, 159-182. Singapore: World Scientific Publishing, 2002., 1999-2002

File — Box: 58, Folder: 16-17

Dates: 1999-2002

Found in: Science History Institute Archives / William A. Lester, Jr. Papers / Series VIII. Publication and Presentation Files / Sub-series 1. Numerical Publication Files

183. Xiao, C., A. Abraham, R. Quinn, F. Hagelberg, and W.A. Lester, Jr., "Comparative Study on the Interaction of Scandium and Copper Atoms with Small Silicon Clusters,” Journal of Physical Chemistry 106 (2002): 11380-11393., 2002

File — Box: 58, Folder: 18

Dates: 2002

Found in: Science History Institute Archives / William A. Lester, Jr. Papers / Series VIII. Publication and Presentation Files / Sub-series 1. Numerical Publication Files

184. Hagelberg, F., C. Xiao, and W.A. Lester, Jr., “Cagelike Si12 with Endohedral Cu, Mo, and W Metal Atom Impurities,” Physical Review B 67 (2003): 035426-1-035426-9., 2002-2003

File — Box: 58, Folder: 19

Dates: 2002-2003

Found in: Science History Institute Archives / William A. Lester, Jr. Papers / Series VIII. Publication and Presentation Files / Sub-series 1. Numerical Publication Files

186. Harkless, J.A.W., J.H. Rodriguez, L. Mitas, and W.A. Lester, Jr., “A Quantum Monte Carlo and Density Functional Theory Study of the Electronic Structure of Peroxynitrite Anion,” The Journal of Chemical Physics 118, no. 11 (March 15, 2003): 4987-4992., 2002-2003

File — Box: 58, Folder: 20

Dates: 2002-2003

Found in: Science History Institute Archives / William A. Lester, Jr. Papers / Series VIII. Publication and Presentation Files / Sub-series 1. Numerical Publication Files

188. Kolias, A.C. and W.A. Lester, Jr., “Quantum Monte Carlo and Electron Localization Function Study of the Electronic Structure of CO2+,” Journal of Molecular Structure (Theochem) 634 (2003): 1-9., 1997-2003

File — Box: 58, Folder: 21

Dates: 1997-2003

Found in: Science History Institute Archives / William A. Lester, Jr. Papers / Series VIII. Publication and Presentation Files / Sub-series 1. Numerical Publication Files

192. Aspuru-Guzik, A., O. El Akramine, J.C. Grossman, and W.A. Lester, Jr., “Quantum Monte Carlo for Electronic Excitations of Free-Base Porphyrin,” The Journal of Chemical Physics 120, no. 7 (February 15, 2004): 3049-3050., 2002-2004

File — Box: 58, Folder: 22

Dates: 2002-2004

Found in: Science History Institute Archives / William A. Lester, Jr. Papers / Series VIII. Publication and Presentation Files / Sub-series 1. Numerical Publication Files

Box 58

Restricted

Contains 23 Results:

178. Lester, W.A., Jr., “Research Developments and Progress During the Nineties,” Journal of Molecular Structure (Theochem) 573 (2001): 55-62., 2001

179. Krokidis, X., N.W. Moriarty, W.A. Lester, Jr., and M. Frenklach, “A Quantum Monte Carlo Study of Energy Differences in C4H3 and C4H5 Isomers,” International Journal of Chemical Kinetics 33 (2001): 808-820., 2001

180. Almeida, A.L., J.B.L. Martins, E. Longo, N.C. Furtado, C.A. Taft, J.R. Sambrano, and W.A. Lester, Jr., “Theoretical Study of MgO(001) Surfaces: Pure, Doped with Fe, Ca, and Al, and with and without Absorbed Water,” International Journal of Quantum Chemistry 84 (2001): 705-713., 2000

181. Xiao, C., F. Hagelberg, and W.A. Lester, Jr., “Geometric, Energetic, and Bonding Properties of Neutral and Charged Copper-Doped Silicon Clusters,” Physical Review B 66 (2002): 075425-1-075425-23., 2002

183. Xiao, C., A. Abraham, R. Quinn, F. Hagelberg, and W.A. Lester, Jr., "Comparative Study on the Interaction of Scandium and Copper Atoms with Small Silicon Clusters,” Journal of Physical Chemistry 106 (2002): 11380-11393., 2002

184. Hagelberg, F., C. Xiao, and W.A. Lester, Jr., “Cagelike Si12 with Endohedral Cu, Mo, and W Metal Atom Impurities,” Physical Review B 67 (2003): 035426-1-035426-9., 2002-2003

186. Harkless, J.A.W., J.H. Rodriguez, L. Mitas, and W.A. Lester, Jr., “A Quantum Monte Carlo and Density Functional Theory Study of the Electronic Structure of Peroxynitrite Anion,” The Journal of Chemical Physics 118, no. 11 (March 15, 2003): 4987-4992., 2002-2003

188. Kolias, A.C. and W.A. Lester, Jr., “Quantum Monte Carlo and Electron Localization Function Study of the Electronic Structure of CO2+,” Journal of Molecular Structure (Theochem) 634 (2003): 1-9., 1997-2003

192. Aspuru-Guzik, A., O. El Akramine, J.C. Grossman, and W.A. Lester, Jr., “Quantum Monte Carlo for Electronic Excitations of Free-Base Porphyrin,” The Journal of Chemical Physics 120, no. 7 (February 15, 2004): 3049-3050., 2002-2004

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