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quan-tum
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CDFCI
C++ implemented Coordinate Descent Full Configuration Interaction (CDFCI) package for quantum chemistry calculation.
BSD 3-Clause "New" or "Revised" License
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SCF energy difference
#3
dgwvfxn
opened
3 years ago
0
Not finding ground state
#2
uwhbliu
opened
4 years ago
2
Increase max_wavefunction_size
#1
uwhbliu
closed
4 years ago
3