Isaiah Shavitt : A Memorial Festschrift from Theoretical Chemistry Accounts / / edited by Ron Shepard, Russell M. Pitzer, Thom Dunning
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| Titolo: |
Isaiah Shavitt : A Memorial Festschrift from Theoretical Chemistry Accounts / / edited by Ron Shepard, Russell M. Pitzer, Thom Dunning
|
| Pubblicazione: | Berlin, Heidelberg : , : Springer Berlin Heidelberg : , : Imprint : Springer, , 2016 |
| Edizione: | 1st ed. 2016. |
| Descrizione fisica: | 1 online resource (346 p.) |
| Disciplina: | 541.0113 |
| Soggetto topico: | Chemistry, Physical and theoretical |
| Atomic structure | |
| Molecular structure | |
| Theoretical and Computational Chemistry | |
| Atomic/Molecular Structure and Spectra | |
| Physical Chemistry | |
| Persona (resp. second.): | ShepardRon |
| PitzerRussell M | |
| DunningThom | |
| Note generali: | Description based upon print version of record. |
| Nota di bibliografia: | Includes bibliographical references at the end of each chapters. |
| Nota di contenuto: | From the Contents: The Second Order Ehrenfest Method A Practical CASSCF Approach to Coupled Electron-Nuclear Dynamics -- Anchoring the Potential Energy Surface for the Br + H2O → HBr + OH Reaction -- Isaiah Shavitt - Computational Chemistry Pioneer.-Comparison of one-dimensional and quasi-one-dimensional Hubbard models from the variational two-electron reduced-density-matrix method -- Steric and electrostatic effects on photoisomerization dynamics using QM/MM ab initio multiple spawning. |
| Sommario/riassunto: | In this Festschrift dedicated to the late Isaiah Shavitt (1925-2012) , selected researchers in theoretical chemistry present research highlights on major developments in the field. Originally published in the journal Theoretical Chemistry Accounts, these outstanding contributions are now available in a hardcover print format, as well as a special electronic edition. This volume provides valuable content for all researchers in theoretical chemistry, and will especially benefit those research groups and libraries with limited access to the journal. |
| Titolo autorizzato: | Isaiah Shavitt |
| ISBN: | 3-662-48148-0 |
| Formato: | Materiale a stampa  |
| Livello bibliografico | Monografia |
| Lingua di pubblicazione: | Inglese |
| Record Nr.: | 9910254056103321 |
| Lo trovi qui: | Univ. Federico II |
| Opac: | Controlla la disponibilità qui |
Serie:
Highlights in Theoretical Chemistry, . 2194-8666 ; ; 9