changed keyword names to be consistent with publication #399
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zellerf
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Feb 3, 2025
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yeah, but it's alright! I also updated the git sub-module once again, just saw neudecker-group/libpvol#5 |
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Some keywords initiating pvol calcs have been changed, to be consistent with the example file given in https://doi.org/10.26434/chemrxiv-2024-xx932