{ "item_title" : "Advances Chem Physics V 93 C", "item_author" : [" Prigogine", "Rice "], "item_description" : "The use of quantum chemistry for the quantitative prediction ofmolecular properties has long been frustrated by the technicaldifficulty of carrying out the needed computations. In the lastdecade there have been substantial advances in the formalism andcomputer hardware needed to carry out accurate calculations ofmolecular properties efficiently. These advances have beensufficient to make quantum chemical calculations a reliable toolfor the quantitative interpretation of chemical phenomena and aguide to laboratory experiments. However, the success of theserecent developments in computational quantum chemistry is not wellknown outside the community of practitioners. In order to make thelarger community of chemical physicists aware of the current stateof the subject, this self-contained volume of Advances in ChemicalPhysics surveys a number of the recent accomplishments incomputational quantum chemistry.This stand-alone work presents the cutting edge of research incomputational quantum mechanics. Supplemented with more than 150illustrations, it provides evaluations of a broad range of methods, including: * Quantum Monte Carlo methods in chemistry* Monte Carlo methods for real-time path integration* The Redfield equation in condensed-phase quantum dynamics* Path-integral centroid methods in quantum statistical mechanicsand dynamics* Multiconfigurational perturbation theory-applications inelectronic spectroscopy* Electronic structure calculations for molecules containingtransition metals* And moreContributors to New Methods in Computational QuantumMechanicsKERSTIN ANDERSSON, Department of Theoretical Chemistry, ChemicalCenter, SwedenDAVID M. CEPERLEY, National Center for Supercomputing Applicationsand Department of Physics, University of Illinois atUrbana-Champaign, IllinoisMICHAEL A. COLLINS, Research School of Chemistry, AustralianNational University, Canberra, AustraliaREINHOLD EGGER, Fakult t f r Physik, Universit tFreiburg, Freiburg, GermanyANTHONY K. FELTS, Department of Chemistry, Columbia University, NewYorkRICHARD A. FRIESNER, Department of Chemistry, Columbia University, New YorkMARKUS P. F LSCHER, Department of Theoretical Chemistry, Chemical Center, SwedenK. M. HO, Ames Laboratory and Department of Physics, Iowa StateUniversity, Ames, IowaC. H. MAK, Department of Chemistry, University of SouthernCalifornia, Los Angeles, CaliforniaPER- KE Malmqvist, Department of Theoretical Chemistry, Chemical Center, SwedenMANUELA MERCH n, Departamento de Qu mica F sica, Universitat de Val ncia, SpainLUBOS MITAS, National Center for Supercomputing Applications andMaterials Research Laboratory, University of Illinois atUrbana-Champaign, IllinoisSTEFANO OSS, Dipartimento di Fisica, Universitdi Trento andIstituto Nazionale di Fisica della Materia, Unitdi Trento, ItalyKRISTINE PIERLOOT, Department of Chemistry, University of Leuven, BelgiumW. THOMAS POLLARD, Department of Chemistry, Columbia University, New YorkBJ RN O. ROOS, Department of Theoretical Chemistry, ChemicalCenter, SwedenLUIS SERRANO-ANDR S, Department of Theoretical Chemistry, Chemical Center, SwedenPER E. M. SIEGBAHN, Department of Physics, University of Stockholm, Stockholm, SwedenWALTER THIEL, Institut f r Organische Chemie, Universit tZ rich, Z rich, SwitzerlandGREGORY A. VOTH, Department of Chemistry, University ofPennsylvania, PennsylvaniaC. Z. Wang, Ames Laboratory and Department of Physics, Iowa StateUniversity, Ames, Iowa", "item_img_path" : "https://covers4.booksamillion.com/covers/bam/0/47/114/321/0471143219_b.jpg", "price_data" : { "retail_price" : "546.95", "online_price" : "546.95", "our_price" : "546.95", "club_price" : "546.95", "savings_pct" : "0", "savings_amt" : "0.00", "club_savings_pct" : "0", "club_savings_amt" : "0.00", "discount_pct" : "10", "store_price" : "" } }

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