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# libmsym v0.2.0 | ||
libmsym is a C library dealing with point group symmetry in molecules. | ||
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# molecules | ||
## molecules | ||
Determine, symmetrize and generate molecules of any point group as well determine/select subgroups. | ||
Get symmetrically equivalent elements and symmetrize translation of any any element in a molecule. | ||
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#character tables | ||
## character tables | ||
Generate character tables for any point group (complex characters form reducible representations) | ||
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#wave functions | ||
## wave functions | ||
Generate SALCs of real spherical harmonics for non icosahedral point groups with real characters (Ci, Cs, Cnv, Dn, Dnh, Dnd, Td, O and Oh) for any angular momentum, as well as symmetrize orbitals, determine partner functions etc. | ||
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# Notes | ||
## notes | ||
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v0.1.0 is not compatible with v0.2.0 |