000			01249nam a2200205Ia 4500
008			140223b2009 xxu||||| |||| 00| 0 eng d
020			_a9783527317998 _c0.00
082			_a541.22 _bCOM
100			_aComba, Peter
245			_aMolecular Modeling of Inorganic Compunds
250			_a3rd ed
260			_aWeinheim _bWILEY-VCH Verlag Gmbh & Co. _c2009
300			_a326p
500			_aPCG00258 After the second edition introduced first density functional theory aspects, this third edition expands on this topic and offers unique practice in molecular mechanics calculations and DFT. In addition, the tutorial with its interactive exercises has been completely revised and uses the very latest software, a full version of which is enclosed on CD, allowing readers to carry out their own initial experiments with forcefield calculations in organometal and complex chemistry.
700			_aMartin, Bodo
700			_aHambley, Trevor W.
890			_aGermany
891			_aScience & Technology - Chemistry {QuickPic}
995			_ACOM _B009246 _CCHB-CHE _D7044.05 _E0 _F049 _G43780 _H0 _I0.00 _J10513.50 33% _L20100309 _M04 _UC _W20100323 _XBooks India _ZReference
999			_c15890 _d15890