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Large-scale calculations of gas phase thermochemistry: Enthalpy of formation, standard entropy, and heat capacity

Published Online: 2016-09-19

Published Print: 2016-09-21

Authors

Ghahremanpour, Mohammad M.

van Maaren, Paul J. https://orcid.org/0000-0002-6068-4585
Ditz, Jonas C.

Lindh, Roland

van der Spoel, David https://orcid.org/0000-0002-7659-8526
Funding

Funding for this research was provided by:

Swedish National Infrastructure for Computing (SNIC2013-26-6)

Vetenskapsrådet (2012-3910)

Vetenskapsrådet (2013-5947)
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Text and Data Mining valid from 2016-09-19

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