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snelliott / aquarius
Forked from devinamatthews/aquariusAquarius is a parallel quantum chemistry package built on the Cyclops Tensor Framework which provides high-performance structured tensor operations. Aquarius is primarily focused on iterative metho…
nyee / RMG-Java
Forked from ReactionMechanismGenerator/RMG-JavaThe Java version of RMG: Reaction Mechanism Generator