Recent advances in multireference methods:
Gespeichert in:
| Format: | Elektronisch E-Book |
|---|---|
| Sprache: | English |
| Veröffentlicht: |
Singapore
World Scientific
©1999
|
| Schriftenreihe: | Recent advances in computational chemistry
v. 4 |
| Schlagworte: | |
| Online-Zugang: | FAW01 FAW02 Volltext |
| Beschreibung: | Includes bibliographical references The Configuration-Driven Approach for Multireference Configuration Interaction Calculations - R.J. Buenker and S. Krebs -- - Multi-Reference Perturbation Theory - E.R. Davidson and A.A. Jarzecki -- - Response Theories Based on a State-Specific Multireference Coupled Cluster Formalism - S. Chattopadhyay, U.S. Mahapatra and D. Mukherjee -- - Multireference Coupled Pair Approximation: A State-Universal Approach of a CEPA Type Variant of MRSDCI - K. Tanaka, T. Sakai and Y. Mochizuki -- - Analytic Energy Gradients for Second-Order Multireference Perturbation Theory - H. Nakano, N. Osuka and K. Hirao -- - Multiconfigurational Perturbation Theory Applied to Excited States of Organic Compounds - M. Merchan, L. Serrano-Andres and M.P. Fulscher - [and others] This book presents the most recent and important developments in multireference-based approaches and their applications. Its main purpose is to highlight essential aspects of the frontiers of multireference theory and provide readers with the fundamental knowledge necessary for further development |
| Beschreibung: | 1 Online-Ressource (ix, 214 pages) |
| ISBN: | 9789810237776 9789812812186 9810237774 9812812180 |
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| id | DE-604.BV043117159 |
| illustrated | Not Illustrated |
| indexdate | 2024-07-10T07:17:57Z |
| institution | BVB |
| isbn | 9789810237776 9789812812186 9810237774 9812812180 |
| language | English |
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| physical | 1 Online-Ressource (ix, 214 pages) |
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| publishDate | 1999 |
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| publisher | World Scientific |
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| series2 | Recent advances in computational chemistry |
| spelling | Recent advances in multireference methods edited by K Hirao Singapore World Scientific ©1999 1 Online-Ressource (ix, 214 pages) txt rdacontent c rdamedia cr rdacarrier Recent advances in computational chemistry v. 4 Includes bibliographical references The Configuration-Driven Approach for Multireference Configuration Interaction Calculations - R.J. Buenker and S. Krebs -- - Multi-Reference Perturbation Theory - E.R. Davidson and A.A. Jarzecki -- - Response Theories Based on a State-Specific Multireference Coupled Cluster Formalism - S. Chattopadhyay, U.S. Mahapatra and D. Mukherjee -- - Multireference Coupled Pair Approximation: A State-Universal Approach of a CEPA Type Variant of MRSDCI - K. Tanaka, T. Sakai and Y. Mochizuki -- - Analytic Energy Gradients for Second-Order Multireference Perturbation Theory - H. Nakano, N. Osuka and K. Hirao -- - Multiconfigurational Perturbation Theory Applied to Excited States of Organic Compounds - M. Merchan, L. Serrano-Andres and M.P. Fulscher - [and others] This book presents the most recent and important developments in multireference-based approaches and their applications. Its main purpose is to highlight essential aspects of the frontiers of multireference theory and provide readers with the fundamental knowledge necessary for further development SCIENCE / Chemistry / Physical & Theoretical bisacsh Quantum chemistry fast Chemie Quantum chemistry Hirao, K. Sonstige oth http://search.ebscohost.com/login.aspx?direct=true&scope=site&db=nlebk&db=nlabk&AN=514047 Aggregator Volltext |
| spellingShingle | Recent advances in multireference methods SCIENCE / Chemistry / Physical & Theoretical bisacsh Quantum chemistry fast Chemie Quantum chemistry |
| title | Recent advances in multireference methods |
| title_auth | Recent advances in multireference methods |
| title_exact_search | Recent advances in multireference methods |
| title_full | Recent advances in multireference methods edited by K Hirao |
| title_fullStr | Recent advances in multireference methods edited by K Hirao |
| title_full_unstemmed | Recent advances in multireference methods edited by K Hirao |
| title_short | Recent advances in multireference methods |
| title_sort | recent advances in multireference methods |
| topic | SCIENCE / Chemistry / Physical & Theoretical bisacsh Quantum chemistry fast Chemie Quantum chemistry |
| topic_facet | SCIENCE / Chemistry / Physical & Theoretical Quantum chemistry Chemie |
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