DOI: 10.1016/0009-2614(71)80294-4. Rapid geometry optimization for semi-empirical molecular orbital methods

Rapid geometry optimization for semi-empirical molecular orbital methods

10.1016/0009-2614(71)80294-4

Crossref journal-article

Elsevier BV

Chemical Physics Letters (78)

Bibliography

McIver, J. W., & Komornicki, A. (1971). Rapid geometry optimization for semi-empirical molecular orbital methods. Chemical Physics Letters, 10(3), 303â306.

Authors 2

J.W. McIver (first)
A. Komornicki (additional)

References 18 Referenced 322

10.1021/ja00753a007 / J. Am. Chem. Soc. by Lathan (1971)
10.1063/1.1673611 / J. Chem. Phys. by Newton (1970)
10.1063/1.1669925 / J. Chem. Phys. by Gordon (1968)
10.1063/1.1701476 / J. Chem. Phys. by Pople (1965)
10.1021/ja00716a003 / J. Am. Chem. Soc. by Bodor (1970)
10.1021/ja00706a029 / J. Am. Chem. Soc. by Dewar (1970)
10.1063/1.1670299 / J. Chem. Phys. by Gerratt (1968)
10.1063/1.1670300 / J. Chem. Phys. by Gerratt (1968)
10.1007/BF00533620 / Theoret. Chim. Acta by Moccia (1967)
10.1063/1.1734456 / J. Chem. Phys. by Hoffmann (1963)
{'key': '10.1016/0009-2614(71)80294-4_BIB9', 'author': 'Davidon', 'year': '1959', 'journal-title': 'A.E.C. Res. Develop. Rep., ANL 5990'} / A.E.C. Res. Develop. Rep., ANL 5990 by Davidon (1959)
10.1093/comjnl/6.2.163 / Computer J. by Fletcher (1963)
10.1093/comjnl/13.2.185 / Computer J. by Murtagh (1970)
10.1093/comjnl/7.2.155 / Computer J. by Powell (1964)
H.F. King, to be published
10.1021/ja00993a001 / J. Am. Chem. Soc. by Pople (1967)
{'key': '10.1016/0009-2614(71)80294-4_BIB15_1', 'year': '1958'} (1958)
{'key': '10.1016/0009-2614(71)80294-4_BIB15_2', 'year': '1965'} (1965)

Dates

Type	When
Created	23 years ago (July 25, 2002, 5:09 a.m.)
Deposited	6 years, 3 months ago (May 4, 2019, 9:20 a.m.)
Indexed	2 months, 3 weeks ago (May 27, 2025, 11:47 a.m.)
Issued	54 years ago (Aug. 1, 1971)
Published	54 years ago (Aug. 1, 1971)
Published Print	54 years ago (Aug. 1, 1971)

Funders 0

None

BibTeX

@article{McIver_1971, title={Rapid geometry optimization for semi-empirical molecular orbital methods}, volume={10}, ISSN={0009-2614}, url={http://dx.doi.org/10.1016/0009-2614(71)80294-4}, DOI={10.1016/0009-2614(71)80294-4}, number={3}, journal={Chemical Physics Letters}, publisher={Elsevier BV}, author={McIver, J.W. and Komornicki, A.}, year={1971}, month=aug, pages={303–306} }

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