000			01877cam a22004337i 4500
001			19963770
003			OSt
005			20250615112213.0
008			170825t20152015ctuac g b 001 0 eng d
010			_a 2017302702
020			_a9781935522034
020			_a1935522035
035			_a(OCoLC)ocn936083788
040			_aYDXCP _beng _cYDXCP _erda _dEWF _dOCLCF _dMAC _dNHM _dDLC
042			_alccopycat
050	0	0	_aQD39.3.E46 F67 2015 _bF67 2015
082	0	0	_a542/.85 _223
100	1		_aForesman, James B., _eauthor.
245	1	0	_aExploring chemistry with electronic structure methods / _cJames B. Foresman, Æleen Frisch.
250			_aThird edition
264		1	_aWallingford, CT : _bGaussian, Inc., _c2015.
264		4	_c©2015
300			_axv, 531 pages : _billustrations (chiefly color), portraits (some color) ; _c25 cm
336			_atext _btxt _2rdacontent
336			_astill image _bsti _2rdacontent
337			_aunmediated _bn _2rdamedia
338			_avolume _bnc _2rdacarrier
504			_aIncludes bibliographical references (pages 503-522) and index.
505	0		_aUsing Computations in Chemical Research -- Getting Started with Calculations -- Geometry Optimizations -- Predicting Chemical Properties -- Modeling Chemistry in Solution -- Studying Reaction Mechanisms -- Predicting Spectra -- Modeling Excited States -- Advanced Modeling Techniques -- The Theoretical Background -- Molecule index.
650		0	_aChemistry _xData processing.
650		0	_aChemical models.
650		7	_aChemical models. _2fast _0(OCoLC)fst00853066
650		7	_aChemistry _xData processing. _2fast _0(OCoLC)fst00853366
700	1		_aFrisch, AEleen, _eauthor.
856	4	2	_uhttp://expchem3.com/ _zBook's companion web site.
906			_a7 _bcbc _ccopycat _d2 _encip _f20 _gy-gencatlg
942			_2lcc _cBK _n0
999			_c1328 _d1328