#Orca-quantum-chemistry
Showing 3 of 3 repositories tagged #orca-quantum-chemistry, ranked by stars
radi0sus
xyz2tab
Convert XYZ data to bond lengths & angles, calculate contacts, planes and dihedral angles and print tables
Score
100
★ 38
⑂ 7
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Python
radi0sus
orca_ir
Plots IR spectra from from ORCA output files
Score
0
★ 23
⑂ 4
—
Python
radi0sus
orca_uv
Plots absorption spectra from from ORCA output files
Score
50
★ 21
⑂ 12
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Python