PyVCI Activity

Vibrational configuration interaction code for simulating IR spectra

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Activity for PyVCI

10 years ago
PyVCI released /PyVCI.tgz
10 years ago
PyVCI released /benchmark_VCI_data.tgz
1 decade ago
PyVCI released /code/force_field/molecule_N2H2.py
1 decade ago
PyVCI released /code/change_endianness/reverse_byte_order.pyx
1 decade ago
PyVCI released /code/force_field/molecule.py
1 decade ago
PyVCI released /code/change_endianness/setup_cyth.py
1 decade ago
PyVCI released /code/change_endianness/make_clean
1 decade ago
PyVCI released /code/change_endianness/change_endianness.py
1 decade ago
PyVCI released /code/change_endianness/reverse_byte_order.c
1 decade ago
PyVCI released /code/force_field/force_field_class.py
1 decade ago
PyVCI released /code/to_normal_mode_cyth.pyx
1 decade ago
PyVCI released /code/vci.py
1 decade ago
PyVCI released /code/vci_get_matrices.pyx
1 decade ago
PyVCI released /code/to_normal_mode_cyth.c
1 decade ago
PyVCI released /code/constants.py
1 decade ago
PyVCI released /code/to_normal_mode_c.c
1 decade ago
PyVCI released /code/useful.py
1 decade ago
PyVCI released /code/normal_mode.py
1 decade ago
PyVCI released /code/pyvci.py
1 decade ago
PyVCI released /code/make_clean
1 decade ago
PyVCI released /code/pes_derivs.py
1 decade ago
PyVCI released /code/state.py
1 decade ago
PyVCI released /code/numerical_differentiation.py
1 decade ago
PyVCI released /code/read_input.py
1 decade ago
PyVCI released /code/vci_get_matrices.c
1 decade ago
PyVCI released /code/setup_cyth.py
1 decade ago
PyVCI released /code/to_normal_mode.pyx
1 decade ago
PyVCI released /docs/example_5.pdf
1 decade ago
PyVCI released /docs/MIT_license.txt
1 decade ago
PyVCI released /docs/example_1b.pdf
1 decade ago
PyVCI released /docs/PyVCI_manual.tex
1 decade ago
PyVCI released /docs/PyVCI_manual_bib.bib
1 decade ago
PyVCI released /docs/example_1a.pdf
1 decade ago
PyVCI released /docs/example_3.pdf
1 decade ago
PyVCI released /docs/PyVCI_manual.pdf
1 decade ago
PyVCI released /docs/example_4.pdf
1 decade ago
PyVCI released /docs/example_2.pdf
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m4.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p3.outp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m4m5.outp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p2p6.inp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m1m2.inp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m5m6.outp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p2p4.inp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m3m5.outp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m2.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m1m6.outp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m1m5.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p6.inp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m4m6.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m1m2.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p1.outp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p1p6.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p3p6.inp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p1p3.inp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p2.inp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m4m6.inp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m1m4.inp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m3m4.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p1p6.inp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p1p5.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p4p5.inp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p3p6.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p2p3.outp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m1m6.inp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p1p2.inp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/num_diff_diazene.outp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m6.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p2.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m2m5.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m3.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m1m4.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m4.inp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m1m5.outp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p2p6.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m2m6.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p4.inp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p1p3.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m4m6.outp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p3p5.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p2p6.outp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m3m6.inp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m3.outp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p1p3.outp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m5.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m2m5.inp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p2p4.outp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m1m3.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m3m4.outp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p1p4.inp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p1p2.outp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m5.outp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p3p4.outp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p1p2.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m2m3.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p4p5.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p3.inp
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_m1m6.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p5p6.dat
1 decade ago
PyVCI released /tutes/tute_1a/QFF/diazene_p5p6.inp

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