dorsal/arxiv
View SchemaW1 and W2 Theories, and Their Variants: Thermochemistry in the kJ/mol Accuracy Range
| Authors | Jan M. L. Martin, S. Parthiban |
|---|---|
| Categories | |
| ArXiv ID | physics/0511008 |
| URL | https://arxiv.org/abs/physics/0511008 |
| Journal | Chapter 2, pp. 31-65 in "Quantum Mechanical Prediction of Thermochemical Data" (ed. Jerzy Cioslowski), Understanding Chemical Reactivity, vol. 22, Kluwer Academic Publishers, Dordrecht, The Netherlands, 2001 |
Abstract
In this 2nd chapter of the book Quantum Mechanical Prediction of Thermochemical Data" (ed. Jerzy Cioslowski, Kluwer, 2001; ISBN 0-7923-7077-5), we review the nonempirical computational thermochemistry methods W1 and W2 theory and their variants. The chapter is made available online following a change in publisher E-print policy.
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"abstract": "In this 2nd chapter of the book Quantum Mechanical Prediction of\nThermochemical Data\" (ed. Jerzy Cioslowski, Kluwer, 2001; ISBN 0-7923-7077-5),\nwe review the nonempirical computational thermochemistry methods W1 and W2\ntheory and their variants. The chapter is made available online following a\nchange in publisher E-print policy.",
"arxiv_id": "physics/0511008",
"authors": [
"Jan M. L. Martin",
"S. Parthiban"
],
"categories": [
"physics.chem-ph",
"physics.comp-ph"
],
"journal_ref": "Chapter 2, pp. 31-65 in \"Quantum Mechanical Prediction of\n Thermochemical Data\" (ed. Jerzy Cioslowski), Understanding Chemical\n Reactivity, vol. 22, Kluwer Academic Publishers, Dordrecht, The Netherlands,\n 2001",
"title": "W1 and W2 Theories, and Their Variants: Thermochemistry in the kJ/mol Accuracy Range",
"url": "https://arxiv.org/abs/physics/0511008"
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