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Speedup by using multiple cores with PCM enabled for single gradient evaluation.

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posted on 2013-07-02, 02:18 authored by Casper SteinmannCasper Steinmann, Kristoffer L. Blædel, Anders S. Christensen, Jan H. Jensen

Speedup by using multiple cores with PCM enabled for single gradient evaluation.

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    chemical biologycomputational chemistryAb initio methodsSemi-empirical methodsorganic chemistryPhysical chemistrythermodynamicsquantum chemistryTheoretical chemistryClassical mechanicsPhysical laws and principlescorespcmenabledgradient

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