2
votes
Is it possible to plot the pDOS or visualize the molecular orbitals from GAMESS outputs?
Yes, you can get what you want. If you have a Gaussian .fch file, you can visualize MOs using GaussView/Multiwfn/... any GUI you like. And you can plot PDOS by loading the .fch file in Multiwfn(http://...
- 646
2
votes
Error when trying to compile (after everything else has been done) GAMESS on Windows/WSL
I installed GFortran 9.4 and re-ran the compall file. The compilation succeeded but the gamess.00.x file was missing and GAMESS ...
- 870
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