000			01867nam a2200373 i 4500
001			16174
005			20260105113115.0
008			980427t20041999enka b 001 0 eng
020			_a0471980854 _q(alkaline paper)
020			_a9780471980858 _q(alkaline paper)
020			_a0471984256 _q(paperback : alkaline paper)
020			_a9780471984252 _q(paperback : alkaline paper)
035			_a(OCoLC)39051789 _z(OCoLC)40397369 _z(OCoLC)60196962
040			_aDLC _beng _cDLC _dUBA _dUKM _dBAKER _dNLGGC _dBTCTA _dYDXCP _dHEBIS _dDEBBG _dOCLCQ _dZWZ _dOD$ _dOCLCO _dOCLCF _dOCLCQ _dOCLCO _dUtOrBLW _erda
041	0		_atur
049			_aBAUN_MERKEZ
050	0	4	_aQD455.3.E4 _bI46 2004
082	0	0	_221
100	1		_aJensen, Frank _988151 _eaut
245	1	0	_aIntroduction to computational chemistry / _cFrank Jensen
246	3	0	_aComputational chemistry
264		1	_aChichester ; _aNew York : _bWiley, _c2004.
264		4	_c©1999
300			_axvi, 429 pages : _billustrations ; _c26 cm
336			_atext _btxt _2rdacontent
337			_aunmediated _bn _2rdamedia
338			_avolume _bnc _2rdacarrier
504			_aIncludes bibliographical references and index
505	0	0	_t-- Force Field Methods _t-- Electronic Structure Methods _t-- Electron Correlation Methods _t-- Basis Sets _t-- Density Functional Theory _t-- Valence Bond Methods _t-- Relativistic Methods _t-- Wave Function Analysis _t-- Molecular Properties _t-- Illustrating the Concepts _t-- Transition State Theory and Statistical Mechanics _t-- Change of Coordinate System _t-- Optimization Techniques _t-- Qualitative Theories _t-- Simulations, Time-dependent Methods and Solvation Models _t-- Concluding Remarks _t-- Appendices _t-- Index
650		0	_aChemistry, Physical and theoretical _xData processing
650		0	_aChemistry, Physical and theoretical _xMathematics
900			_bSatın
942			_2lcc _cKT
999			_c13848 _d13848