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Chemissian 4.23

Chemissian 4.23
Chemissian 4.23 | 7 Mb


Chemissian is an analyzing tool of molecules electronic structure and spectra. It can manipulate molecular orbital energy-level diagrams (Hartree-Fock and Kohn-Sham orbitals), calculated and experimental UV-VIS electronic spectra, electronic/spin density maps and prepare them for publication. Chemissian has a user-friendly graphical interface and lets you examine and visualize data from the output of Gaussian, US-Gamess, Firefly/PC-Gamess, Q-Chem, Molpro, NWChem and Spartan quantum chemical program packages. Chemissian tools helps you to investigate nature of transitions in UV-vis spectra, bonding nature, etc.
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