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100   $a20191213d2020      uy             0
101 0 $aeng
135   $aurcnu||||||||
181   $ctxt$2rdacontent
182   $cc$2rdamedia
183   $acr$2rdacarrier
200 10$aMolecular interactions $econcepts and methods /$fDavid A. Micha
210  1$aHoboken, NJ :$cWiley,$d2020.
215   $a1 online resource (402 pages)
311   $a0-470-29074-9 
330   $a"Chapters in this book begin with coverage of the concepts and methods for simpler systems, then move on to more advanced subjects for complex systems. Each chapter begins with qualitative aspects before these are treated in quantitative fashion. The first four chapters include the established concepts and quantitative aspects of long-range (electrostatic, induction and dispersion) forces and how they extend to intermediate and short ranges, for ground and excited states. They are followed by chapters dealing with recent developments including electronically non-adiabatic interactions, correlated many-electron treatments, generalized density functional theory, decomposition and embedding of molecular fragments for large systems, and very recent developments using artificial intelligence with network training for many-atom systems"--$cProvided by publisher.
606   $aIntermolecular forces
606   $aMolecular dynamics
615  0$aIntermolecular forces.
615  0$aMolecular dynamics.
676   $a541.226
700   $aMicha$b David A.$01219432
801  0$bMiAaPQ
801  1$bMiAaPQ
801  2$bMiAaPQ
906   $aBOOK
912   $a9910555038703321
996   $aMolecular interactions$92819660
997   $aUNINA