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Computational photochemistry / edited by M. Olivucci.

By: Contributor(s): Material type: TextTextLanguage: English Series: Theoretical and computational chemistry ; 16 | Publication details: Amsterdam ; Boston : Elsevier, 2005.Edition: 1st edDescription: xv, 352 p. : ill. : 25 cmISBN:
  • 9780444521101 (alk. paper)
  • 0444521100 (alk. paper)
Subject(s): DDC classification:
  • 541.350 22 OLI
Online resources:
Contents:
I. Computational photochemistry II. Ab initio methods for excited states III. Density functional methods for excited states IV. Electronic and vibronic spectra of molecular systems : models and simulations based on quantum chemically computed molecular parameters V. Semiclassical nonadiabatic trajectory computations in photochemistry : is the reaction path enough to understand a photochemical reaction mechanism? VI. Computation of Photochemical Reaction Mechanisms in Organic Chemistry. VII. Computation of Reaction Mechanisms and Dynamics in Photobiology VIII. Development of Theory with Computation IX. Calculation of Electronic Spectra of Transition Metal Complexes X. Perspectives in Calculations on Excited State in Molecular Systems
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Item type Current library Collection Call number Status Date due Barcode
Reference Books Reference Books CUTN Central Library Reference Non-fiction 541.350 OLI (Browse shelf(Opens below)) Not For Loan 36703

Erratum slip inserted.

I. Computational photochemistry II. Ab initio methods for excited states III. Density functional methods for excited states IV. Electronic and vibronic spectra of molecular systems : models and simulations based on quantum chemically computed molecular parameters V. Semiclassical nonadiabatic trajectory computations in photochemistry : is the reaction path enough to understand a photochemical reaction mechanism? VI. Computation of Photochemical Reaction Mechanisms in Organic Chemistry. VII. Computation of Reaction Mechanisms and Dynamics in Photobiology VIII. Development of Theory with Computation IX. Calculation of Electronic Spectra of Transition Metal Complexes X. Perspectives in Calculations on Excited State in Molecular Systems

Includes bibliographical references and index.

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