Ab initio calculations of vibrational spectra of nonrigid molecules-Reference-Cited by-同舟云学术

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Ab initio calculations of vibrational spectra of nonrigid molecules

Published:1990-07 Issue:14 Volume:94 Page:5493-5496
ISSN:0022-3654
Container-title:The Journal of Physical Chemistry
language:en
Short-container-title:J. Phys. Chem.

Author:

Carsky Petr.,Spirko Vladimir.,Hess B. Andes.,Schaad Lawrence J.

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,General Engineering

Link

https://pubs.acs.org/doi/pdf/10.1021/j100377a014

Cited by 19 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Spectroscopy in Complex Environments from QM–MM Simulations;Chemical Reviews;2018-03-21

2. High-Accuracy Extrapolated ab Initio Thermochemistry of the Propargyl Radical and the Singlet C3H2 Carbenes;The Journal of Physical Chemistry A;2009-07-07

3. Structure of Triplet Propynylidene (HCCCH) as Probed by IR, UV/vis, and EPR Spectroscopy of Isotopomers;Journal of the American Chemical Society;2009-06-16

4. Density functional theoretical (DFT) study for the prediction of spectroscopic parameters of ClCCCN;Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy;2006-11

5. Calculation of non-fundamental IR frequencies and intensities at the anharmonic level. I. The overtone, combination and difference bands of diazomethane, H2CN2;Chemical Physics;2001-11

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