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The PR for inclusion in psi can be found here: psi4/psi4#1057 |
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@venkatkapil24 and @OndrejMarsalek can you also look into this? seems another quick merger |
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This PR adds a small python Client class, which can be used in other codes to easily implement a new force driver as well as adds input files to provide an example to run i-pi together with psi.
I'll also open a pull request to psi and get the rest of this connection implemented on the other side as well.