![]() UserOptions = 'Hamiltonian or DFT method to use' If you want to know if they’ve loaded correctly, go in and change something, like the basis sets: userOptions = IIRC the GitHub repository also as “solvation” as an option in orca.py I don’t remember offhand if there’s something new, but I think PySCF was added recently. The versions you downloaded are likely slightly newer than in the last released version. The point of downloading is that you can update those scripts without needing a new release of Avogadro. ![]() We decided not to restrict extensions because someone might want to write in Shell or Ruby or Julia or whatever. On launch, it will go through the files and track which ones it can run. The bottom line is that I think the input generator files are in the right directory, but avogadro2 doesn’t seem to recognize them.īut there are no directions to install them or what to look for.Īnything that’s not a script will get ignored. There are no instructions to know if the input generators have been read properly or read at all.Īvogadro2 -> Extensions -> Plugin Downloader provides text.īut, I don’t see anything about the input generators.ĭon’t you think some more information could be provided to make the install process a little smoother. There are no instructions on what to do with plugin.json. There are no instructions on what to do with generators.cmake. README.md gamessuk.py* generators.cmake molpro.py* nwchem.py* plugin.json pyscf.py* terachem.py* LICENSE dalton.py* gaussian.py* inputgeneratortest.py* mopac.py* orca.py* psi4.py* qchem.py* The only instructions provided are that they should be placed in a directory where avogadro2 can read them. home/rossi/.local/share/OpenChemistry/Avogadro/generators I downloaded the avogadro2 input generators. ![]() This is my second time asking a question about this. ![]()
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