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A powerful object oriented programming language.

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I'm searching for semi-empirical quantum chemistry solver which would be easy to integrate into my own software. I found a few implementations which can be in principle used e.g. MOPAC, ORCA, SQM some …
asked Jun 19 '17 by Prokop Hapala
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I know lot of density functional packages in fortran, including one which we are developing in our group (Fireball-DFT) but I don't like fortran very much and I would like something which is easier t …
asked May 11 '17 by Prokop Hapala