First Principles Studies of the Vibrationally Resolved Magnetic Circular Dichroism Spectra of Biphenylene-Reference-Cited by-同舟云学术

First Principles Studies of the Vibrationally Resolved Magnetic Circular Dichroism Spectra of Biphenylene

Published:2013-02-15 Issue:3 Volume:9 Page:1557-1567
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Lin Na¹²,Solheim Harald²,Zhao Xian¹,Santoro Fabrizio³,Ruud Kenneth²

Affiliation:

1. State Key Laboratory of Crystal Materials, Shandong University, 250100 Jinan, Shandong, People’s Republic of China

2. Centre for Theoretical and Computational Chemistry, Department of Chemistry, University of Tromsø, N-9037 Tromsø, Norway

3. Consiglio Nazionale delle Ricerche—CNR, Istituto di Chimica dei Composti Organo Metallici (ICCOM-CNR), UOS di Pisa, Area della Ricerca, Via G. Moruzzi 1, I-56124 Pisa, Italy

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/ct301101h

Reference62 articles.

1. Magnetic Optical Activity

2. Theory of Magnetic Circular Dichroism

3. Magnetic Circular Dichroism

4. Ab initio calculation of magnetic circular dichroism

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