Computational methods in photochemistry / edited by Andrei G. Kutateladze.

Format:

Book

Contributor:

Kutateladze, Andrei G.

Series:

Molecular and supramolecular photochemistry ; 13.

Molecular and supramolecular photochemistry ; 13

Language:

English

Subjects (All):

Photochemistry--Textbooks.

Photochemistry.

Photochemistry--Mathematical models.

Models, Theoretical.

Medical Subjects:

Photochemistry.

Models, Theoretical.

Genre:

Textbooks.

Physical Description:

ix, 517 pages : illustrations ; 24 cm.

Place of Publication:

Boca Raton : Taylor & Francis, 2005.

Contents:

Some theoretical applications of organic photochemistry: excited state and open shell examples / Howard E. Zimmerman

Computational investigation of photochemical reaction mechanisms / Lluís Blancafort ... [et al.]

Spin-orbit coupling / Zdenek Havlas, Mojmír Kývala, and Josef Michl

Photochemistry from first principles and direct dynamics / Alessandro Toniolo ... [et al.]

Study of nitrenes by theoretical methods / Nina P. Gritsan ... [et al]

Semiempirical MR-CI calculations for organic photoreactions / Martin Klessinger

Naural bond orbital analysis of photochemical excitation, with illustrative applications to vinoxy radical / F. Weinhold

Theoretical approach to solid-state organic photochemistry: mechanic and exploratory organic photochemistry / Howard E. Zimmerman.

Notes:

Includes bibliographical references and index.

ISBN:

0824753453

OCLC:

56387137

Publisher Number:

9780824753450