Found: 12
Select item for more details and to access through your institution.
Efficient calculation of electrically based intermolecular potentials of weakly bonded clusters.
- Published in:
- Journal of Computational Chemistry, 1988, v. 9, n. 5, p. 476, doi. 10.1002/jcc.540090506
- By:
- Publication type:
- Article
Polarization counterpoise corrections to correlated hydrogen bond interaction energies.
- Published in:
- Journal of Computational Chemistry, 1987, v. 8, n. 1, p. 81, doi. 10.1002/jcc.540080110
- By:
- Publication type:
- Article
An open-ended self-consistent field method. A simulation of a molecular orbital technique for small memory computers.
- Published in:
- Journal of Computational Chemistry, 1982, v. 3, n. 2, p. 260, doi. 10.1002/jcc.540030218
- By:
- Publication type:
- Article
Recent computational developments with the self-consistent electron pairs method and application to the stability of glycine conformers.
- Published in:
- Journal of Computational Chemistry, 1981, v. 2, n. 3, p. 266, doi. 10.1002/jcc.540020308
- By:
- Publication type:
- Article
Diacetylene's weak bonding to acetylene clusters.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2003, v. 110, n. 2, p. 100, doi. 10.1007/s00214-003-0458-y
- By:
- Publication type:
- Article
The significance of double substitutions in well-correlated electronic wave functions.
- Published in:
- International Journal of Quantum Chemistry, 1983, v. 24, p. 289, doi. 10.1002/qua.560240833
- By:
- Publication type:
- Article
Evolution of polarizabilities and hyperpolarizabilities with molecular aggregation: A model study of acetylene clusters.
- Published in:
- International Journal of Quantum Chemistry, 1992, v. 43, n. 1, p. 135, doi. 10.1002/qua.560430112
- By:
- Publication type:
- Article
First derivatives of correlated wave functions by a matrix-oriented method: Preliminary application to molecular dipole and quadrupole moments.
- Published in:
- International Journal of Quantum Chemistry, 1985, v. 28, n. 3, p. 411, doi. 10.1002/qua.560280308
- By:
- Publication type:
- Article
Quantum monte carlo vibrational dynamics in a property-based interaction potential scheme for weakly bound clusters.
- Published in:
- Journal of Computational Chemistry, 1997, v. 18, n. 5, p. 702, doi. 10.1002/(SICI)1096-987X(19970415)18:5<702::AID-JCC10>3.0.CO;2-E
- By:
- Publication type:
- Article
Concise, open-ended implementation of Rys polynomial evaluation of two-Electron integrals.
- Published in:
- Journal of Computational Chemistry, 1990, v. 11, n. 8, p. 972, doi. 10.1002/jcc.540110809
- By:
- Publication type:
- Article
General quantum mechanical operators. An open-ended approach for one-electron integrals with Gaussian bases.
- Published in:
- Journal of Computational Chemistry, 1990, v. 11, n. 1, p. 105, doi. 10.1002/jcc.540110113
- By:
- Publication type:
- Article
Enhanced second-order treatment of electron pair correlation.
- Published in:
- International Journal of Quantum Chemistry, 2000, v. 78, n. 4, p. 226, doi. 10.1002/(SICI)1097-461X(2000)78:4<226::AID-QUA4>3.0.CO;2-N
- By:
- Publication type:
- Article