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Jun 23, 2021
Eller, Johannes; Matzerath, Tanja; van Westen, Thijs; Gross, Joachim, 2021, "Supporting Information: Solute Configurations in n-hexane, cyclohexane and benzene", https://doi.org/10.18419/darus-1734, DaRUS, V1
This data set contains the intramolecular configurations of the considered solute molecules in n-hexane, cyclohexane and benzene used to calculate solvation free energies using classical density functional theory based on the PC-SAFT equation of state. The files include the carte... |
application/vnd.enliven - 984 B -
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application/vnd.enliven - 828 B -
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application/vnd.enliven - 820 B -
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application/vnd.enliven - 984 B -
MD5: 86207bfe4c83c73764d8138141b675bc
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application/vnd.enliven - 1.1 KB -
MD5: 4f9100d3ee166b991f2f81f679401d7d
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application/vnd.enliven - 1.1 KB -
MD5: 90c47df805b6b04364915c9852113e39
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