Quantum-mechanical prediction of thermochemical data /

• Other Authors: Cioslowski, Jerzy
• Format: eBook
• Language: English
• Published: Dordrecht ; Boston : Kluwer Academic Publishers, �2001.
• Series: Understanding chemical reactivity ; v. 22.
• Subjects: Thermochemistry.; Quantum chemistry.; SCIENCE > Chemistry > Physical & Theoretical.; Quantenchemie; Thermochemie; Electronic books.

The contemporary chemist interested in predicting thermochemical properties such as the standard enthalpy of formation has at his disposal a wide selection of theoretical approaches, differing in the range of applicability, computational cost, and the expected accuracy. Ranging from high-level treat...