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Iopenshell.usc.edu: Laboratory for Theoretical Studies of Electronic Structure and Spectroscopy of Open-Shell and Electronically Excited Species - iOpenShell Offline

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Questions and answers - iOpenShell

iOpenShell My calculation keeps failing, what should I check? Usually the outputs of calculations give the clue about what went wrong. The most common things that may be wrong are...
Laboratory for Theoretical Studies of Electronic Structure and Spectroscopy of Open-Shell and Electronically Excited Species

News Our weekly Blitz meetings are held on Mondays, 10:15-11:00 am PST, via Zoom. Connect through this link. Our group seminar is on Wednesdays, noon, in a hybrid mode (SSC 604 and Zoom)....

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iOpenShell Dr. Anna Krylov, Professor of Chemistry I like EOM-CC methods, open-shells, molecular orbitals and Hückel theory, spectroscopy, second quantization, size-extensive wave ...