عنوان

Electron correlation methodology /

(Number (ISBN

084123843X (alk. paper)

(Number (ISBN

9780841238435 (alk. paper)

Number

b428855

Title Proper

Electron correlation methodology /

General Material Designation

[Book]

First Statement of Responsibility

Angela K. Wilson, editor, Kirk A. Peterson, editor ; sponsored by the ACS divisions of Physical Chemistry and Computers in Chemistry

Place of Publication, Distribution, etc.

[Oxford] :

Name of Publisher, Distributor, etc.

Distributed by Oxford University Press,

Date of Publication, Distribution, etc.

c2007

Specific Material Designation and Extent of Item

x, 218 p. :

Other Physical Details

ill. ;

Dimensions

24 cm

Series Title

ACS symposium series ;

ISSN of Series

958

Text of Note

Includes bibliographical references and indexes

Text of Note

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 ... [et al.] -- Bond breaking in quantum chemistry: a comparison of single-and multi-reference methods / C. David Sherrill ... [et al.] -- 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 ... [et al.] -- Equilibrium structure of the silicon trimer / John F. Stanton

0

Electron configuration, Congresses

Number

Edition

Class number

Class number

Book number

Book number

Peterson, Kirk A

Wilson, Angela K

American Chemical Society., Division of Computers in Chemistry

American Chemical Society., Division of Physical Chemistry

Date of Transaction

20080519000000.0

Electronic name

[Book]

Y