000 01028cam a22002777a 4500
999 _c509
_d509
001 TB589
003 IN-BhIIT
005 20221209160616.0
008 100301s2009 enka b 001 0 eng d
020 _a9780521898638 (hbk.)
020 _a0521898633 (hbk.)
040 _aIN-BhIIT
041 _aeng
082 0 4 _a541.394
_bMAR/A
100 1 _aMarx, Dominik.
_eauthor
_96889
245 1 0 _aAb initio molecular dynamics :
_bbasic theory and advanced methods /
_cby Dominik Marx and Jürg Hutter
260 _aCambridge, New York :
_bCambridge University Press,
_c2009.
300 _ax, 567 p. :
_bill. ;
_c26 cm.
504 _aIncludes bibliographical references and index.
650 0 _aMolecular dynamics
_xComputer simulation.
_96890
700 1 _aHutter, Jürg.
_96891
856 4 2 _uhttp://www.loc.gov/catdir/enhancements/fy1007/2010286603-b.html
856 4 2 _uhttp://www.loc.gov/catdir/enhancements/fy1007/2010286603-d.html
856 4 1 _uhttp://www.loc.gov/catdir/enhancements/fy1007/2010286603-t.html
942 _cTB
_04