DOI: 10.1021/ja00385a002. Effect of electron correlation of theoretical equilibrium geometries. 2. Comparison of third-order perturbation and configuration interaction results with experiment

Effect of electron correlation of theoretical equilibrium geometries. 2. Comparison of third-order perturbation and configuration interaction results with experiment

10.1021/ja00385a002

Crossref journal-article

American Chemical Society (ACS)

Journal of the American Chemical Society (316)

Bibliography

DeFrees, D. J., Raghavachari, K., Schlegel, H. B., & Pople, J. A. (1982). Effect of electron correlation of theoretical equilibrium geometries. 2. Comparison of third-order perturbation and configuration interaction results with experiment. Journal of the American Chemical Society, 104(21), 5576â5580.

Authors 4

Douglas J. DeFrees (first)
Krishnan Raghavachari (additional)
H. Bernhard Schlegel (additional)
John A. Pople (additional)

References 0 Referenced 117

None

Dates

Type	When
Created	20 years, 5 months ago (March 18, 2005, 1:26 p.m.)
Deposited	2 years, 5 months ago (March 30, 2023, 12:27 p.m.)
Indexed	1 year, 6 months ago (Feb. 10, 2024, 7:33 p.m.)
Issued	42 years, 11 months ago (Oct. 1, 1982)
Published	42 years, 11 months ago (Oct. 1, 1982)
Published Online	23 years, 4 months ago (May 1, 2002)
Published Print	42 years, 11 months ago (Oct. 1, 1982)

Funders 0

None

BibTeX

@article{DeFrees_1982, title={Effect of electron correlation of theoretical equilibrium geometries. 2. Comparison of third-order perturbation and configuration interaction results with experiment}, volume={104}, ISSN={1520-5126}, url={http://dx.doi.org/10.1021/ja00385a002}, DOI={10.1021/ja00385a002}, number={21}, journal={Journal of the American Chemical Society}, publisher={American Chemical Society (ACS)}, author={DeFrees, Douglas J. and Raghavachari, Krishnan and Schlegel, H. Bernhard and Pople, John A.}, year={1982}, month=oct, pages={5576–5580} }

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