| Year |
Citation |
Score |
| 2008 |
Li J, Duke BJ, Klapötke TM, McWeeny R. Spin density of spin-free valence bond wave functions and its implementation in VB2000 Journal of Theoretical and Computational Chemistry. 7: 853-867. DOI: 10.1142/S0219633608004167 |
0.307 |
|
| 2007 |
McWeeny R. Spiers Memorial Lecture. Quantum chemistry: the first seventy years. Faraday Discussions. 135: 13-30; discussion 12. PMID 17328421 DOI: 10.1039/B615518A |
0.455 |
|
| 2002 |
Li J, McWeeny R. VB2000: Pushing valence bond theory to new limits International Journal of Quantum Chemistry. 89: 208-216. DOI: 10.1002/Qua.10293 |
0.376 |
|
| 2001 |
McWeeny R. Symbols in science Advances in Quantum Chemistry. 40: 1-16. DOI: 10.1016/S0065-3276(01)40006-2 |
0.368 |
|
| 1999 |
McWeeny R. Valence bond theory a re-examination of concepts and methodology Theoretical and Computational Chemistry. 6: 365-401. DOI: 10.1016/S1380-7323(99)80015-6 |
0.4 |
|
| 1999 |
McWeeny R. On the Einstein-Podolsky-Rosen Paradox Advances in Quantum Chemistry. 36: 365-384. DOI: 10.1016/S0065-3276(08)60492-X |
0.338 |
|
| 1999 |
McWeeny R, Amovilli C. Locality and nonlocality in quantum mechanics: A two-proton EPR experiment * Dedicated to George Hall—a master-builder of mathematical models. International Journal of Quantum Chemistry. 74: 573. DOI: 10.1002/(Sici)1097-461X(1999)74:5<573::Aid-Qua13>3.3.Co;2-K |
0.572 |
|
| 1999 |
McWeeny R, Amovilli C. Locality and nonlocality in quantum mechanics: A two-proton EPR experiment International Journal of Quantum Chemistry. 74: 573-584. DOI: 10.1002/(Sici)1097-461X(1999)74:5<573::Aid-Qua13>3.0.Co;2-T |
0.574 |
|
| 1999 |
Mcweeny R. An ab initio form of classical valence-bond theory International Journal of Quantum Chemistry. 74: 87-96. DOI: 10.1002/(Sici)1097-461X(1999)74:2<87::Aid-Qua5>3.0.Co;2-E |
0.432 |
|
| 1998 |
McWeeny R. Separability of Quantum Systems: A Density Matrix Approach Advances in Quantum Chemistry. 31: 15-35. DOI: 10.1016/S0065-3276(08)60181-1 |
0.355 |
|
| 1997 |
Pavlov RL, Maruani J, Delchev YI, McWeeny R. Density functional theory for open-shell systems using a local-scaling transformation scheme. I. Single-density energy functional International Journal of Quantum Chemistry. 65: 241-256. DOI: 10.1002/(Sici)1097-461X(1997)65:3<241::Aid-Qua5>3.0.Co;2-W |
0.319 |
|
| 1996 |
McWeeny R. Ionization and attachment in valence bond theory Chemical Physics. 204: 463-468. DOI: 10.1016/0301-0104(95)00329-0 |
0.451 |
|
| 1995 |
Amovilli C, McWeeny R. Molecular interactions: a study of charge transfer effects Chemical Physics. 198: 71-77. DOI: 10.1016/0301-0104(95)00105-W |
0.502 |
|
| 1995 |
Wu W, McWeeny R. A study of the C-Li bond in methyllithium and of the potential energy surface for bond breaking Journal of Molecular Structure: Theochem. 341: 279-288. DOI: 10.1016/0166-1280(95)93229-G |
0.35 |
|
| 1992 |
McWeeny R. The electron affinity of H2 : a valence bond study Journal of Molecular Structure: Theochem. 261: 403-413. DOI: 10.1016/0166-1280(92)87089-I |
0.315 |
|
| 1991 |
Amovilli C, McWeeny R. Shape and similarity: two aspects of molecular recognition Journal of Molecular Structure: Theochem. 227: 1-9. DOI: 10.1016/0166-1280(91)85268-C |
0.572 |
|
| 1991 |
Amovilli C, Harcourt RD, McWeeny R. Correlation energy and the use of Linnett-type orbitals in VB calculations for benzene and pyridine Chemical Physics Letters. 187: 494-499. DOI: 10.1016/0009-2614(91)80289-A |
0.605 |
|
| 1990 |
Amovilli C, McWeeny R. A matrix partitioning approach to the calculation of intermolecular potentials. General theory and some examples Chemical Physics. 140: 343-361. DOI: 10.1016/0301-0104(90)80002-F |
0.568 |
|
| 1990 |
McWeeny R. Valence bond theory: Progress and prospects International Journal of Quantum Chemistry. 38: 733-752. DOI: 10.1002/Qua.560382473 |
0.33 |
|
| 1988 |
McWeeny R, Jorge FE. Hybridization in valence bond theory: The water molecule Journal of Molecular Structure: Theochem. 169: 459-468. DOI: 10.1016/0166-1280(88)80277-X |
0.381 |
|
| 1988 |
McWeeny R. Classical structures in modern valence bond theory Theoretica Chimica Acta. 73: 115-122. DOI: 10.1007/Bf00528198 |
0.378 |
|
| 1988 |
McWeeny R. A spin‐free form of valence bond theory International Journal of Quantum Chemistry. 34: 25-36. DOI: 10.1002/Qua.560340105 |
0.417 |
|
| 1986 |
Amovilli C, McWeeny R. Perturbation calculations of molecular interaction energies: an example, HF....HF Chemical Physics Letters. 128: 11-17. DOI: 10.1016/0009-2614(86)80137-3 |
0.617 |
|
| 1985 |
McWeeny R. Electron density and response theory Journal of Molecular Structure: Theochem. 24: 231-242. DOI: 10.1016/0166-1280(85)80167-6 |
0.396 |
|
| 1984 |
McWeeny R. Simple models for large-molecule calculations International Journal of Quantum Chemistry. 26: 693-708. DOI: 10.1002/Qua.560260509 |
0.38 |
|
| 1983 |
McWeeny R. Some remarks on multiconfiguration time-dependent Hartree-Fock theory International Journal of Quantum Chemistry. 23: 405-416. DOI: 10.1002/Qua.560230209 |
0.392 |
|
| 1982 |
Jaszu?ski M, Pickup BT, McWeeny R. Problems in electron propagator calculations of the correlation energy Chemical Physics Letters. 90: 167-171. DOI: 10.1016/0009-2614(82)80018-3 |
0.619 |
|
| 1980 |
McWeeny R, Pickup BT. Quantum theory of molecular electronic structure Reports On Progress in Physics. 43: 1065-1144. DOI: 10.1088/0034-4885/43/9/001 |
0.646 |
|
| 1978 |
Firsht D, Pickup BT, McWeeny R. The generalized SCF transition operator Chemical Physics. 29: 67-76. DOI: 10.1016/0301-0104(78)85062-9 |
0.496 |
|
| 1965 |
Klessinger M, McWeeny R. Self-consistent group calculations on polyatomic molecules. I. Basic theory with an application to methane The Journal of Chemical Physics. 42: 3343-3354. |
0.552 |
|
| 1949 |
McWeeny R, Coulson CA. The computation of wave functions in momentum space - I: The helium atom Proceedings of the Physical Society. Section A. 62: 509-518. DOI: 10.1088/0370-1298/62/8/306 |
0.395 |
|
| 1948 |
McWeeny R, Coulson CA. Quantum mechanics of the anharmonic oscillator Mathematical Proceedings of the Cambridge Philosophical Society. 44: 413-422. DOI: 10.1017/S0305004100024415 |
0.438 |
|
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