[PDF.11lk] The Consistent Force Field: A Documentation (Lecture Notes in Chemistry)

The Consistent Force Field: A Documentation (Lecture Notes in Chemistry)

[PDF.ha22] The Consistent Force Field: A Documentation (Lecture Notes in Chemistry)

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 | #9646143 in Books |  Springer |  1977-08-04 | Original language:English | PDF # 1 |  9.61 x.52 x6.69l,.81 | File type: PDF | 212 pages

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In this chapter ve shall discuss the calculation of potential energy associated vith molecular conforaations. Raving obtained cartesian atoaic coordinates defining conforaations. and lists of intraao- cular interactions, as described in Chapter 3, ve are ready to calculate a quantity which in the chemical literature is known as the total aolecular potential energy or the conforaational, steric, strain or intraaolecular energy. he conformational energy of a aolecule can b...

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