000 00685nam a2200145Ia 4500
008 220419s9999 xx 000 0 und d
040 _cJayakar Knowledge Resource Center
100 _aGanesh, V
_eResearcher
_915132
245 0 _cGanesh, V
_aAb initio treatment of large molecular systems algorithm development, parallelization and applications
260 _c2008
_aPune
_bSavitribai Phule Pune University
653 _aQuantum chemistry codes||Cardinality guided molecular tailoring approach||Geometry optimization||Hessian matrix||Webprop interface
700 _aGadre, Shridhar R
_eGuide
_95186
856 _uhttp://lib.unipune.ac.in:8080/xmlui/handle/123456789/2212
942 _c5
999 _c409371
_d409371