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WIP: Mrchem+DMRG #518
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WIP: Mrchem+DMRG #518
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Use existing functionality to compute integral matrices
Use momentum operator to compute kinetic energy integral
Member
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I have made a two electron integral code in #532 , so that we can write: (How can I propose my merged branch directly as a pr into your pr?) |
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Sorry for the late reply, I think you should send a PR to the forked MRChem here: https://github.com/martinanibbi/mrchem/tree/mrchem-dmrg |
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Work in progress: Integration of DMRG in MRChem.