DOI: 10.1016/s0009-2614(01)00564-4. Comparison of full-configuration interaction and coupled-cluster harmonic and fundamental frequencies for BH and HF

Comparison of full-configuration interaction and coupled-cluster harmonic and fundamental frequencies for BH and HF

10.1016/s0009-2614(01)00564-4

Crossref journal-article

Elsevier BV

Chemical Physics Letters (78)

Bibliography

Larsen, H., Olsen, J., JÃ¸rgensen, P., & Gauss, J. (2001). Comparison of full-configuration interaction and coupled-cluster harmonic and fundamental frequencies for BH and HF. Chemical Physics Letters, 342(1â2), 200â206.

Authors 4

Helena Larsen (first)
Jeppe Olsen (additional)
Poul Jørgensen (additional)
Jürgen Gauss (additional)

References 27 Referenced 14

S.R. Langhoff (Ed.), Quantum Mechanical Electronic Structure Calculations with Chemical Accuracy, Kluwer Academic Publishers, Dordrecht, 1995, p. 47 (10.1007/978-94-011-0193-6)
For further references, see the special issues Spectrochimica Acta, 53 A, (1997), Spectrochimica Acta 55 A, (1999) (10.1016/S1386-1425(97)90000-7)
Preface in Spectrochimica Acta, 53 A, vii (1997) (10.1016/S1386-1425(97)00033-4)
I.M. Mills, in: K.N. Rao, C.W. Matthews (Eds.), Modern Spectroscopy: Modern Research, Academic Press, New York, 1972, p. 115 (10.1016/B978-0-12-580640-4.50013-3)
Spectro, written by J.F. Gaw et al
10.1002/qua.560440876 / Int. J. Quantum Chem. Symp. by Stanton (1992)
{'key': '10.1016/S0009-2614(01)00564-4_BIB7', 'first-page': '225', 'volume': '13', 'author': 'Pople', 'year': '1979', 'journal-title': 'Int. J. Quantum Chem. Symp.'} / Int. J. Quantum Chem. Symp. by Pople (1979)
10.1016/0009-2614(85)87031-7 / Chem. Phys. Lett. by Handy (1985)
10.1016/S0009-2614(97)88036-0 / Chem. Phys. Lett. by Gauss (1997)
10.1039/a909820h / Phys. Chem. Chem. Phys. by Gauss (2000)
10.1016/S0009-2614(97)01400-0 / Chem. Phys. Lett. by Martin (1998)
10.1016/S0009-2614(98)00683-6 / Chem. Phys. Lett. by Martin (1998)
10.1016/0009-2614(95)00841-Q / Chem. Phys. Lett. by Christiansen (1995)
10.1063/1.473322 / J. Chem. Phys. by Koch (1997)
10.1103/PhysRev.46.618 / Phys. Rev. by Møller (1934)
10.1016/S0009-2614(89)87395-6 / Chem. Phys. Lett. by Raghavachari (1989)
10.1016/0009-2614(89)87263-X / Chem. Phys. Lett. by Schneider (1989)
10.1063/1.476136 / J. Chem. Phys. by Stanton (1998)
10.1063/1.456153 / J. Chem. Phys. by Dunning (1989)
10.1063/1.462569 / J. Chem. Phys. by Kendall (1992)
10.1063/1.466439 / J. Chem. Phys. by Woon (1994)
10.1063/1.470645 / J. Chem. Phys. by Woon (1995)
An electronic structure program, Release 1.0 (1997) written by T. Helgaker et al
10.1063/1.1290005 / J. Chem. Phys. by Olsen (2000)
Lucia, a full CI, restricted active space program by J. Olsen, Aarhus, with contributions from H. Larsen
{'key': '10.1016/S0009-2614(01)00564-4_BIB26', 'series-title': 'Molecular Spectra and Molecular Structure. Constants of Diatomic Molecules', 'author': 'Huber', 'year': '1979'} / Molecular Spectra and Molecular Structure. Constants of Diatomic Molecules by Huber (1979)
10.1063/1.1311294 / J. Chem. Phys. by Larsen (2000)

Dates

Type	When
Created	23 years, 1 month ago (July 25, 2002, 8:27 a.m.)
Deposited	5 years, 7 months ago (Jan. 11, 2020, 2:56 a.m.)
Indexed	1 year, 6 months ago (Feb. 10, 2024, 4:04 p.m.)
Issued	24 years, 1 month ago (July 1, 2001)
Published	24 years, 1 month ago (July 1, 2001)
Published Print	24 years, 1 month ago (July 1, 2001)

Funders 0

None

BibTeX

@article{Larsen_2001, title={Comparison of full-configuration interaction and coupled-cluster harmonic and fundamental frequencies for BH and HF}, volume={342}, ISSN={0009-2614}, url={http://dx.doi.org/10.1016/s0009-2614(01)00564-4}, DOI={10.1016/s0009-2614(01)00564-4}, number={1–2}, journal={Chemical Physics Letters}, publisher={Elsevier BV}, author={Larsen, Helena and Olsen, Jeppe and Jørgensen, Poul and Gauss, Jürgen}, year={2001}, month=jul, pages={200–206} }

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