Electron correlation methodology /
| Corporate Authors: | , |
|---|---|
| Other Authors: | , |
| Format: | eBook |
| Language: | English |
| Language Notes: | English. |
| Published: |
Washington, DC : [Oxford] :
American Chemical Society ; Distributed by Oxford University Press,
©2007.
|
| Series: | ACS symposium series ;
958. |
| Subjects: | |
| Online Access: | Connect to the full text of this electronic book |
Table of Contents:
- Explicitly correlated basis functions for large molecules / Claire C.M. Samson and Wirm Klopper
- Uniform density limit of exchange-correlation energy functionals / John P. Perdew, Jianmin Tao, and Stephan Kümmel
- Self-consistent Hartree-Fock-Wigner calculations: a two-electron-density functional theory / Darragh P. O'Neill and Peter M.W. Gill
- New alternatives for accurate electronic structure calculations of potential energy surfaces involving bond breaking / Piotr Piecuch [and others]
- Bond breaking in quantum chemistry: a comparison of single-and multi-reference methods / C. David Sherrill [and others]
- Breaking the curse of the non-dynamical correlation problem: the spin-flip method / Anna I. Krylov, Lyudmila V. Slipchenko, and Sergey V. Levchenko
- Economical description of electron correlation / Laimutis Bytautas and Klaus Ruedenberg
- Correlation consistent basis sets with relativistic effective core potentials: the transition metal elements Y and Hg / Kirk A. Peterson
- Multilevel methods for thermochemistry and thermochemical kinetics / Benjamin J. Lynch and Donald G. Truhlar
- A nonlocal energy functional derived from the fluctuation-dissipation theorem / Katharine L.C. Hunt
- The protonation site of aniline revisited: a 'torture test' for electron correlation methods / A. Daniel Boese [and others]
- Equilibrium structure of the silicon trimer / John F. Stanton.