000			04192cam a2200517Ki 4500
001			9780429154010
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005			20220724194513.0
006			m o d
007			cr |n|||||||||
008			200803s2020 flu ob 000 0 eng d
040			_aOCoLC-P _beng _erda _cOCoLC-P
020			_a9781498762229 _q(electronic bk.)
020			_a1498762220 _q(electronic bk.)
020			_a9780429154010 _q(electronic bk.)
020			_a0429154011 _q(electronic bk.)
020			_a9780429546570 _q(electronic bk. : Mobipocket)
020			_a0429546572 _q(electronic bk. : Mobipocket)
020			_a9780429531873 _q(electronic bk. : EPUB)
020			_a0429531877 _q(electronic bk. : EPUB)
020			_z9781498762212
020			_z1498762212
035			_a(OCoLC)1180973500 _z(OCoLC)1191058539
035			_a(OCoLC-P)1180973500
050		4	_aQD461
072		7	_aSCI _x013050 _2bisacsh
072		7	_aSCI _x013030 _2bisacsh
072		7	_aPNR _2bicssc
082	0	4	_a541/.2240151 _223
100	1		_aFredrickson, Daniel C., _eauthor.
245	1	0	_aBonding through code : _btheoretical models for molecules and materials / _cDaniel C. Fredrickson.
264		1	_aBoca Raton : _bCRC Press, _c2020.
300			_a1 online resource.
336			_atext _btxt _2rdacontent
337			_acomputer _bc _2rdamedia
338			_aonline resource _bcr _2rdacarrier
520			_aThis timely and unique publication is designed for graduate students and researchers in inorganic and materials chemistry and covers bonding models and applications of symmetry concepts to chemical systems. The book discusses the quantum mechanical basis for molecular orbital concepts, the connections between molecular orbitals and localized views of bonding, group theory, bonding models for a variety of compounds, and the extension of these ideas to solid state materials in band theory. Unlike other books, the concepts are made tangible to the readers by guiding them through their implementation in MATLAB functions. No background in MATLAB or computer programming is needed; the book will provide the necessary skills. Key Features Visualization of the Postulates of Quantum Mechanics to build conceptual understanding MATLAB functions for rendering molecular geometries and orbitals Do-it-yourself approach to building a molecular orbital and band theory program Introduction to Group Theory harnessing the 3D graphing capabilities of MATLAB Online access to a growing collection of applications of the core material and other appendices Bonding through Code is ideal for first-year graduate students and advanced undergraduates in chemistry, materials science, and physics. Researchers wishing to gain new tools for theoretical analysis or deepen their understanding of bonding phenomena can also benefit from this text. About the Author Daniel Fredrickson is a Professor in the Department of Chemistry at the University of Wisconsin-Madison, where his research group focuses on understanding and harnessing the structural chemistry of intermetallic phases using a combination of theory and experiment. His interests in crystals, structure, and bonding can be traced to his undergraduate research at the University of Washington (B.S. in Biochemistry, 2000) with Prof. Bart Kahr, his Ph.D. studies at Cornell University (2000-2005) with Profs. Stephen Lee and Roald Hoffmann, and his post-doctoral work with Prof. Sven Lidin at Stockholm University (2005-2008). As part of his teaching at UW-Madison since 2009, he has worked to enhance his department's graduate course, Physical Inorganic Chemistry I: Symmetry and Bonding, through the incorporation of new material and the development of computer-based exercises.
588			_aOCLC-licensed vendor bibliographic record.
650		0	_aChemical bonds _xMathematical models.
630	0	0	_aMATLAB.
650		7	_aSCIENCE / Chemistry / Physical & Theoretical _2bisacsh
650		7	_aSCIENCE / Chemistry / Inorganic _2bisacsh
856	4	0	_3Read Online _uhttps://www.taylorfrancis.com/books/9780429154010
856	4	2	_3OCLC metadata license agreement _uhttp://www.oclc.org/content/dam/oclc/forms/terms/vbrl-201703.pdf
942			_2lcc _cEBK
999			_c18385 _d18385