Isaiah Shavitt

A Memorial Festschrift from Theoretical Chemistry Accounts
Herausgegeben:Shepard, Ron; Pitzer, Russell M.; Dunning, Thom

• Gebundenes Buch

Produktbeschreibung

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.

Produktdetails

• Highlights in Theoretical Chemistry 9
• Verlag: Springer / Springer Berlin Heidelberg / Springer, Berlin
• Artikelnr. des Verlages: 978-3-662-48147-9
• 1st ed. 2016
• Seitenzahl: 368
• Erscheinungstermin: 27. Oktober 2015
• Englisch
• Abmessung: 285mm x 215mm x 26mm
• Gewicht: 1057g
• ISBN-13: 9783662481479
• ISBN-10: 3662481472
• Artikelnr.: 43181304

Autorenporträt

S. C. Zimmerman ¿ R. M. Pitzer

Inhaltsangabe

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.