Combination of theoretical ab initio and experimental information to obtain reliable harmonic force constants. Scaled quantum mechanical (QM) force fields for glyoxal, acrolein, butadiene, formaldehyde, and ethylene

1.4k indexed citations

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This paper, published in 1983, received 1.4k indexed citations. Written by Péter Pulay, Géza Fogarasi, Gábor Pongor, James E. Boggs and A. Vargha covering the research area of Atomic and Molecular Physics, and Optics and Physical and Theoretical Chemistry. It is primarily cited by scholars working on Electronic, Optical and Magnetic Materials (747 citations), Organic Chemistry (621 citations) and Atomic and Molecular Physics, and Optics (547 citations). Published in Journal of the American Chemical Society.

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This paper is also available at doi.org/10.1021/ja00362a005.

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