000			01981cam a22003135a 4500
999			_c26925 _d26897
001			13655336
005			20181101113104.0
008			040715s2004 enka frb 001 0 eng d
010			_a 2004555409
020			_a0521825687 (hardback)
040			_aDLC _beng _cDLC _dDLC _dEG-ScBUE
082	0	4	_a539.6 _bRAP _222
100	1		_aRapaport, D. C. _941864
245	1	4	_aThe art of molecular dynamics simulation / _cD. C. Rapaport.
250			_a2nd ed.
260			_aCambridge ; _aNew York : _bCambridge University Press, _c2004.
300			_axiii, 549 p. : _bill. ; _c26 cm.
504			_aIncludes bibliographical references (p. 519-531) and indexes.
505	0		_aCover; Half-title; Title; Copyright; Contents; Preface to the first edition; Preface to the second edition; About the software; 1 Introduction; 2 Basic molecular dynamics; 3 Simulating simple systems; 4 Equilibrium properties of simple fluids; 5 Dynamical properties of simple fluids; 6 Alternative ensembles; 7 Nonequilibrium dynamics; 8 Rigid molecules; 9 Flexible molecules; 10 Geometrically constrained molecules; 11 Internal coordinates; 12 Many-body interactions; 13 Long-range interactions; 14 Step potentials; 15 Time-dependent phenomena; 16 Granular dynamics.
520			_aThe extremely powerful technique of molecular dynamics simulation involves solving the classical many-body problem in contexts relevant to the study of matter at the atomistic level. The second edition of the book includes a substantial amount of new material as well as completely rewritten software.
650		7	_aCondensed matter _xComputer simulation. _2BUEsh
650		7	_aMolecular dynamics _xComputer simulation. _2BUEsh
651			_2BUEsh
653			_bGGEN _bENGCHE _bENGGEN _cNovember2018
655			_vReading book
856	4	2	_3Publisher description _uhttp://www.loc.gov/catdir/description/cam051/2004555409.html
856	4	1	_3Table of contents _uhttp://www.loc.gov/catdir/toc/fy045/2004555409.html
942			_2ddc