
By Angela K. Wilson, Kirk A. Peterson
content material: Explicitly correlated foundation capabilities for big molecules / Claire C.M. Samson and Wirm Klopper --
Uniform density restrict of exchange-correlation power functionals / John P. Perdew, Jianmin Tao, and Stephan Kümmel --
Self-consistent Hartree-Fock-Wigner calculations: a two-electron-density sensible idea / Darragh P. O'Neill and Peter M.W. Gill --
New possible choices for actual digital constitution calculations of strength power surfaces regarding bond breaking / Piotr Piecuch ... [et al.] --
Bond breaking in quantum chemistry: a comparability of single-and multi-reference equipment / C. David Sherrill ... [et al.] --
Breaking the curse of the non-dynamical correlation challenge: the spin-flip process / Anna I. Krylov, Lyudmila V. Slipchenko, and Sergey V. Levchenko --
least expensive description of electron correlation / Laimutis Bytautas and Klaus Ruedenberg --
Correlation constant foundation units with relativistic potent middle potentials: the transition steel parts Y and Hg / Kirk A. Peterson --
Multilevel tools for thermochemistry and thermochemical kinetics / Benjamin J. Lynch and Donald G. Truhlar --
A nonlocal strength sensible derived from the fluctuation-dissipation theorem / Katharine L.C. Hunt --
The protonation website of aniline revisited: a 'torture attempt' for electron correlation equipment / A. Daniel Boese ... [et al.] --
Equilibrium constitution of the silicon trimer / John F. Stanton.
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