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Spin Contamination Error in Optimized Geometry of Singlet Carbene ((1)A(1)) by Broken-Symmetry Method

Document Type

Journal

Author

Kitagawa, Yasutaka; Saito, Toru; Nakanishi, Yasuyuki; Kataoka, Yusuke; Matsui, Toru; Kawakami, Takashi; Okumura, Mitsutaka; Yamaguchi, Kizashi

Source

JOURNAL OF PHYSICAL CHEMISTRY A; DEC 31 2009, 113 52, p15041-p15046, 6p.

Subject

Language

English

ISSN

10895639

Online Access

Full Text (ACS) Web of Science JCR 저널정보 Scopus Find it@PNU

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