An ab initio, DFT and semiempirical SCF-MO package PDF
534 Pages·2012·29.48 MB·English
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Max-‐Planck-‐Institute for Bioinorganic Chemistry. Stiftstr. 34-‐36, 45470 Mülheim .. 6.2 GEOMETRY OPTIMIZATIONS, SURFACE SCANS, TRANSITION STATES, MECPS .. 130. 6.2.1 Geometry 7.4.3 Basis Set Projection .
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