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Advances in Chemical Physics, Volume 93: New Methods in Computational Quantum Mechanics

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[PDF.ql13] Advances in Chemical Physics, Volume 93: New Methods in Computational Quantum Mechanics

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 | #18451306 in Books |  1996-04-25 | Original language:English | PDF # 1 |  9.61 x1.06 x6.42l,2.51 | File type: PDF | 812 pages

||From the Publisher|This series provides chemical physics with a forum for critical, authoritative evaluations of advances in every area of the discipline. Volume 93 is a special topics, stand-alone volume report recent advances in computational quantum mechanics

The use of quantum chemistry for the quantitative prediction of molecular properties has long been frustrated by the technical difficulty of carrying out the needed computations. In the last decade there have been substantial advances in the formalism and computer hardware needed to carry out accurate calculations of molecular properties efficiently. These advances have been sufficient to make quantum chemical calculations a reliable tool for the quantitative interpretat...

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