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100   $a19860407d1987      uy         0
101 0 $aeng
135   $aur|n|---|||||
181   $ctxt
182   $cc
183   $acr
200 00$aAb initio methods in quantum chemistry$hPart I /$fedited by K.P Lawley
210   $aChichester [West Sussex] ;$aNew York $cWiley$dc1987
215   $a1 online resource (568 p.)
225 1 $aAdvances in chemical physics ;$v67
300   $aDescription based upon print version of record.
311 08$a9780471909002 
311 08$a0471909009 
320   $aIncludes bibliographies and indexes.
327   $aAB INITIO METHODS IN QUANTUM CHEMISTRY-Part I; CONTENTS; EXCITED-STATE POTENTIALS; MOLECULAR PROPERTY DERIVATIVES; TRANSITION STRUCTURE COMPUTATIONS AND THEIR ANALYSIS; OPTIMIZATION OF EQUILIBRIUM GEOMETRIES AND TRANSITION STRUCTURES; RELATIVISTIC QUANTUM CHEMISTRY; EFFECTIVE HAMILTONIANS AND PSEUDO-OPERATORS AS TOOLS FOR RIGOROUS MODELLING; MOLECULAR CALCULATIONS WITH THE DENSITY FUNCTIONAL FORMALISM; BASIS SETS; THE COUPLED PAIR .APPROXIMATION; AUTHOR INDEX; SUBJECT INDEX
330   $aThe Advances in Chemical Physics series provides the chemical physics and physical chemistry fields with a forum for critical, authoritative evaluations of advances in every area of the discipline. Filled with cutting-edge research reported in a cohesive manner not found elsewhere in the literature, each volume of the Advances in Chemical Physics series serves as the perfect supplement to any advanced graduate class devoted to the study of chemical physics.
410  0$aAdvances in chemical physics ;$v67.
606   $aQuantum chemistry
606   $aQuantum theory
615  0$aQuantum chemistry.
615  0$aQuantum theory.
676   $a541.2/8
676   $a541.28
676   $a541.305
676   $a541/.08
701   $aLawley$b K. P$0878056
801  0$bMiAaPQ
801  1$bMiAaPQ
801  2$bMiAaPQ
906   $aBOOK
912   $a9911019659603321
996   $aAb initio methods in quantum chemistry$94417499
997   $aUNINA