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biology : psi88
Plotting wavefunctions (molecular orbitals) in 3D
PSI/88 Version 1.0 by W. L. Jorgensen & D. L. Severance To plot wavefunctions in three dimensions from semi-empirical and most popular ab initio basis sets. Valence semi-empirical, STO-3G, 3-21++G(*) and 6-31++G(d,p) basis sets are implemented for atoms H-Ar.
Version number : 1.0
Md5 : MD5 (psi88.tar.Z) = acccd40ac46430089ec053aa396da41c SHA256 (psi88.tar.Z) = c3aa19bb5cd2ab33acfb8f2aabb2f97cb47943164bdac3ee90e7badb7848f8c7 SIZE (psi88.tar.Z) = 142034
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