John A. Pople
1951–2009 年に発表
- 125
- 論文数
- 179,180
- 被引用数
- 117
- h 指数
- 124
- i10 指数
被引用数
引用元
国・地域
機関
分野
- Chemistry26.4%
- Physics and Astronomy24%
- Materials Science12.6%
- Biochemistry, Genetics and Molecular Biology11.3%
- Computer Science6.8%
- Medicine6.1%
- その他12.8%
トピック
- Advanced Chemical Physics Studies9.6%
- Spectroscopy and Quantum Chemical Studies5.3%
- Computational Drug Discovery Methods3.7%
- Crystallography and molecular interactions2.6%
- Free Radicals and Antioxidants2.5%
- Machine Learning in Materials Science2.3%
- その他74%
共著者
- Warren J. Hehre21
- Krishnan Raghavachari18
- Larry A. Curtiss16
- J. Stephen Binkley14
- Leo Radom13
- Martin Head‐Gordon12
- Michael J. Frisch12
- Peter M. W. Gill10
- Paul C. Redfern9
- Benny G. Johnson8
- R. Krishnan7
- Vitaly A. Rassolov6
- William A. Lathan6
- R. Ditchfield5
- Rolf Seeger5
- Gary W. Trucks4
- Nicholas C. Handy4
- Paul von Ragué Schleyer4
- A. D. Buckingham3
- Gerald A. Segal3
- H. Bernhard Schlegel3
- H. C. Longuet–Higgins3
- Mark A. Ratner3
- Mark S. Gordon3
全論文
- Self-consistent molecular orbital methods. XX. A basis set for correlated wave functions
著者: R. Krishnan, J. Stephen Binkley, Rolf Seeger, John A. Pople - The Journal of Chemical Physics 1980 被引用: 17,506
- Self—Consistent Molecular Orbital Methods. XII. Further Extensions of Gaussian—Type Basis Sets for Use in Molecular Orbital Studies of Organic Molecules
著者: Warren J. Hehre, R. Ditchfield, John A. Pople - The Journal of Chemical Physics 1972 被引用: 15,769
- Self-Consistent Molecular-Orbital Methods. IX. An Extended Gaussian-Type Basis for Molecular-Orbital Studies of Organic Molecules
著者: R. Ditchfield, Warren J. Hehre, John A. Pople - The Journal of Chemical Physics 1971 被引用: 10,542
- The influence of polarization functions on molecular orbital hydrogenation energies
著者: P. C. Hariharan, John A. Pople - Theoretical Chemistry Accounts 1973 被引用: 15,724
- Self-consistent molecular orbital methods 25. Supplementary functions for Gaussian basis sets
著者: Michael J. Frisch, John A. Pople, J. Stephen Binkley - The Journal of Chemical Physics 1984 被引用: 8,496
- Self-consistent molecular orbital methods. XXIII. A polarization-type basis set for second-row elements
著者: Michelle Francl, William J. Pietro, Warren J. Hehre, J. Stephen Binkley, Mark S. Gordon, Douglas J. DeFrees, John A. Pople - The Journal of Chemical Physics 1982 被引用: 8,181
- A fifth-order perturbation comparison of electron correlation theories
著者: Krishnan Raghavachari, Gary W. Trucks, John A. Pople, Martin Head‐Gordon - Chemical Physics Letters 1989 被引用: 8,488
- 6‐31G* basis set for third‐row atoms
著者: Vitaly A. Rassolov, Mark A. Ratner, John A. Pople, Paul C. Redfern, Larry A. Curtiss - Journal of Computational Chemistry 2001 被引用: 2,235
- Self-Consistent Molecular-Orbital Methods. I. Use of Gaussian Expansions of Slater-Type Atomic Orbitals
著者: Warren J. Hehre, R. F. Stewart, John A. Pople - The Journal of Chemical Physics 1969 被引用: 4,194
- 6-31G* basis set for atoms K through Zn
著者: Vitaly A. Rassolov, John A. Pople, Mark A. Ratner, Theresa L. Windus - The Journal of Chemical Physics 1998 被引用: 2,076
- Accuracy of AHnequilibrium geometries by single determinant molecular orbital theory
著者: P. C. Hariharan, John A. Pople - Molecular Physics 1974 被引用: 2,286
- MP2 energy evaluation by direct methods
著者: Martin Head‐Gordon, John A. Pople, Michael J. Frisch - Chemical Physics Letters 1988 被引用: 2,788
- A direct MP2 gradient method
著者: Michael J. Frisch, Martin Head‐Gordon, John A. Pople - Chemical Physics Letters 1990 被引用: 1,839
- Self-consistent molecular orbital methods. 21. Small split-valence basis sets for first-row elements
著者: J. Stephen Binkley, John A. Pople, Warren J. Hehre - Journal of the American Chemical Society 1980 被引用: 3,870
- A method for two-electron Gaussian integral and integral derivative evaluation using recurrence relations
著者: Martin Head‐Gordon, John A. Pople - The Journal of Chemical Physics 1988 被引用: 441
- Nobel Lecture: Quantum chemical models
著者: John A. Pople - Reviews of Modern Physics 1999 被引用: 520
- Self-consistent molecular-orbital methods. 22. Small split-valence basis sets for second-row elements
著者: Mark S. Gordon, J. Stephen Binkley, John A. Pople, William J. Pietro, Warren J. Hehre - Journal of the American Chemical Society 1982 被引用: 2,098
- Assessment of Gaussian-2 and density functional theories for the computation of enthalpies of formation
著者: Larry A. Curtiss, Krishnan Raghavachari, Paul C. Redfern, John A. Pople - The Journal of Chemical Physics 1997 被引用: 2,134
- The performance of the Becke—Lee—Yang—Parr (B—LYP) density functional theory with various basis sets
著者: Peter M. W. Gill, Benny G. Johnson, John A. Pople, Michael J. Frisch - Chemical Physics Letters 1992 被引用: 998
- Gaussian-2 theory for molecular energies of first- and second-row compounds
著者: Larry A. Curtiss, Krishnan Raghavachari, Gary W. Trucks, John A. Pople - The Journal of Chemical Physics 1991 被引用: 3,441
- Self-consistent molecular orbital methods. XV. Extended Gaussian-type basis sets for lithium, beryllium, and boron
著者: James D. Dill, John A. Pople - The Journal of Chemical Physics 1975 被引用: 808
- Derivative studies in hartree-fock and møller-plesset theories
著者: John A. Pople, R. Krishnan, H. Bernhard Schlegel, J. Stephen Binkley - International Journal of Quantum Chemistry 2009 被引用: 313
- Self-Consistent Orbitals for Radicals
著者: John A. Pople, R. K. Nesbet - The Journal of Chemical Physics 1954 被引用: 1,588
- The molecular orbital theory of chemical valency XVI. A theory of paired-electrons in polyatomic molecules
著者: A. C. Hurley, John Edward Lennard-Jones, John A. Pople - Royal Society of London A Mathematical and Physical Sciences, Proceedings of the Royal Society of London A Mathematical and Physical Sciences 1953 被引用: 466
