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1、WordstothereaderabouthowtousethistextbookI.WhatThisBookDoesandDoesNotContainThistextisintendedforusebybeginninggraduatestudentsandadvancedupperdivisionundergraduatestudentsinallareasofchemistry.Itprovides:(i)Anintroductiontothefundamentalsofquantummechanicsasth
2、eyapplytochemistry,(ii)Materialthatprovidesbriefintroductionstothesubjectsofmolecularspectroscopyandchemicaldynamics,(iii)Anintroductiontocomputationalchemistryappliedtothetreatmentofelectronicstructuresofatoms,molecules,radicals,andions,(iv)Alargenumberofexerc
3、ises,problems,anddetailedsolutions.Itdoesnotprovidemuchhistoricalperspectiveonthedevelopmentofquantummechanics.Subjectssuchasthephotoelectriceffect,black-bodyradiation,thedualnatureofelectronsandphotons,andtheDavissonandGermerexperimentsarenotevendiscussed.Topr
4、ovideatextthatstudentscanusetogainintroductorylevelknowledgeofquantummechanicsasappliedtochemistryproblems,suchanon-historicalapproachhadtobefollowed.Thistextimmediatelyexposesthereadertothemachineryofquantummechanics.Sections1and2(i.e.,Chapters1-7),togetherwit
5、hAppendicesA,B,CandE,couldconstituteaone-semestercourseformostfirst-yearPh.D.programsintheU.S.A.Section3(Chapters8-12)andselectedmaterialfromotherappendicesorselectionsfromSection6wouldbeappropriateforasecond-quarterorsecond-semestercourse.Chapters13-15ofSectio
6、ns4and5wouldbeofuseforprovidingalinktoaone-quarterorone-semesterclasscoveringmolecularspectroscopy.Chapter16ofSection5providesabriefintroductiontochemicaldynamicsthatcouldbeusedatthebeginningofaclassonthissubject.Therearemanyquantumchemistryandquantummechanicst
7、extbooksthatcovermaterialsimilartothatcontainedinSections1and2;infact,ourtreatmentofthismaterialisgenerallybrieferandlessdetailedthanonefindsin,forexample,QuantumChemistry,H.Eyring,J.Walter,andG.E.Kimball,J.WileyandSons,NewYork,N.Y.(1947),QuantumChemistry,D.A.M
8、cQuarrie,UniversityScienceBooks,MillValley,Ca.(1983),MolecularQuantumMechanics,P.W.Atkins,OxfordUniv.Press,Oxford,England(1983),orQuantumChemistry,I.N.Levine,PrenticeHall,En