]> www.hackdaworld.org Git - physik/posic.git/history - potentials
deleted config file (as a test)
[physik/posic.git] / potentials /
2009-06-13 hackbardremoved tersoff 1bp function, added PDEBUG define,...
2009-04-30 hackbardfixed compiler warnings
2009-02-06 hackbardadoption of parcas albe sic parameters, dcut of si...
2008-11-04 hackbardPTHREADS printf, made neighbour index thread safe,...
2008-10-30 hackbardadded MATTONI force field (left parameters by now)
2008-10-30 hackbardvirial calc define + default amount threads -> 2
2008-10-16 hackbardpthredas working now (by partitioning atoms into count...
2008-10-08 hackbardpthreads implemented (fucking slow!)
2008-10-07 hackbardnew imp of pthread approach
2008-10-02 hackbardpthreads -> albe fast (beginning)
2008-09-26 hackbardpthread imp started for orig albe (more easier in the...
2008-09-01 hackbardintroduced lowmem lists
2008-09-01 hackbardfixed static lists + first work on lowmem lists
2008-09-01 hackbardsupply c2, d2, c2/d2
2008-08-31 hackbardfirst attempts: parallel, albe_fast. fpu_ctrl. cleaned...
2008-08-18 hackbardfixed virial (for albe pot)
2008-05-28 hackbardfixed tersoff virial calc
2008-05-28 hackbardadded 2b bond check for tersoff
2008-04-25 hackbardmdrun iinit. untested + not working by now!
2008-04-16 hackbardadapted all potential to new scheme + necessary mods...
2008-04-15 hackbardfixed bond analyze, introduced more comfortable set...
2008-04-05 hackbardimplemented basic p ctrl stuff + video with 13 fps
2008-04-03 hackbardoptimized force eval in k loop!
2008-02-12 hackbardextended debugging, implemented fixed position attribute
2007-11-13 hackbardisecurity checkin .. .we have the diffs anyways!
2007-10-02 hackbardchanged signes -> more intuitive!
2007-07-19 hackbardsmall mods to support site energies and kinetic energie...
2007-07-11 hackbardaverage calc moved, more fscking virial testing
2007-07-10 hackbardsafety checkin, gergo here!
2007-05-30 hackbardalbe force calc bug fixed, sic mods, mean virial
2007-05-22 hackbardadded albe potential (still wrong energy!)
2007-05-18 hackbardfirst sic tests
2007-05-03 hackbardput repulsive part to 3bp/j2 function
2007-05-03 hackbardfixed sign
2007-04-27 hackbardadd another way of calculating tersoff + small moldyn...
2007-03-14 hackbardimproved log/report subsystem, playing around w/ pressu...
2007-03-07 hackbardtersoff MAYBE fixed now!
2007-03-05 hackbardadded potential header files
2007-03-05 hackbardnew structure (skipped 2 inlines) same code!
2007-03-05 hackbardnew src file layout (warning: doesnt compile by now!)