| Record Type: |
Electronic resources
: Monograph/item
|
| Title/Author: |
Quantum-mechanical prediction of thermochemical data/ edited by Jerzy Cioslowski. |
| other author: |
Cioslowski, Jerzy. |
| Published: |
Dordrecht ;Kluwer Academic Publishers, : c2001., |
| Description: |
xiv, 252 p. :ill. ;25 cm. |
| Series: |
Understanding chemical reactivity ; |
| [NT 15003449]: |
Highly accurate ab initio computation of thermochemical data / Trygve Helgaker ... [et al.] -- W1 and W2 theories, and their variants : thermochemistry in the kJ/mol accuracy range/ Jan M.L. Martin and S. Parthiban -- Quantum-chemical methods for accurate theoretical thermochemistry / Krishnan Raghavachari and Larry A. Curtiss -- Complete basis set models for chemical reactivity : from the helium atom to enzyme kinetics/ George A. Petersson -- Application and testing of diagonal, partial third-order electron propagator approximations / Antonio M. Ferreira ... [et al.] -- Theoretical thermochemistry of radicals/ David J. Henry and Leo Radom -- Theoretical prediction of bond dissociation energies for transition metal compounds and main group complexes with standard quantum-chemical methods/ Nikolaus Fr鋌hlich and Gernot Frenking -- Theoretical thermochemistry : a brief survey / Walter Thiel. |
| Subject: |
Quantum chemistry. - |
| Online resource: |
https://search.ebscohost.com/login.aspx?direct=true&scope=site&db=nlebk&AN=78539An electronic book accessible through the World Wide Web; click for information |
| ISBN: |
0306476320 (electronic bk.) |