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defining multi-electron states in and initial conditions in libra-devel
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hamid...@yahoo.com
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Mar 5, 2019, 2:55:07 AM
3/5/19
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Dear Libra users
I am new to Libra and want to run a NAMD simulation using this code.
I am wondering how the multi-electron states and initial conditions are given in Libra. Are the procedures the same as the ones used in pyxaid?
Best
Hamid
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