]> hackdaworld.org Git - physik/posic.git/history - sic.c
sualization mods + adabtions
[physik/posic.git] / sic.c
2007-08-02 hackbardsualization mods + adabtions
2007-07-25 hackbardchanges to visualization, not finished by now!
2007-07-23 hackbardadded postproc stuff, sic mods (today i was a lazy...
2007-07-19 hackbardsmall mods to support site energies and kinetic energie...
2007-07-17 hackbardprepared another way of carbon injection
2007-07-12 hackbardruntime schedule adding and injection of c atoms origin
2007-07-11 hackbardaverage calc moved, more fscking virial testing
2007-07-10 hackbardsafety checkin, gergo here!
2007-07-06 hackbardsome fixes
2007-07-05 hackbardadded fluctuation calc code
2007-07-03 hackbardchanged energy fluctuation calc and heat cap calc
2007-06-29 hackbardstill playing around with heat capacity ...
2007-06-27 hackbardadded post proc stuff
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 hackbardnew structure (skipped 2 inlines) same code!
2007-01-31 hackbardcreate_lattice fixes, still virial probs ...
2007-01-26 hackbardpt scaling tests, though pressure estimation still...
2007-01-25 hackbardnur foo ...
2007-01-24 hackbardstill pressure (+ fixes with cubic lattce and ho potent...
2007-01-23 hackbardadded report system, still messing around with virial...
2007-01-17 hackbard...
2007-01-15 hackbardcleaning + set hook function
2007-01-12 hackbardstill full of bugs ...
2006-12-18 hackbardfoo
2006-12-17 hackbardtesting foo
2006-12-15 hackbardpot hopefully ok, doing timestep tests for 450C now ...
2006-12-15 hackbardactually just bullshit ... (added unique tag -> maybe...
2006-12-14 hackbardjust foo
2006-12-14 hackbardsafety ci
2006-12-14 hackbardnew linked list system, still a pain inthe ...
2006-12-13 hackbardbasic p control added, virial still needed!
2006-12-13 hackbardsafety checkin
2006-12-12 hackbardfixed 2bp, todo: adjust create lattice, then go for 3bp
2006-12-12 hackbardsafety checkin
2006-12-11 hackbardscaling to fs, angstrom, amu done, probs with velocity...
2006-12-11 hackbardbc check probs
2006-12-11 hackbardsecurity checkin
2006-12-10 hackbardmods to corect 3bp derivative, still segfaulting ...
2006-12-07 hackbardmore tersoff changes, still a mess!
2006-12-05 hackbardfunc2b is now again real func2b ... still -> nan! :/
2006-12-05 hackbardsome bugfixes ... com'on
2006-12-04 hackbardno segfaulst anymore BUT take care, definetly calculati...
2006-12-04 hackbardadded 2bp post function .. this is getting sick!
2006-12-01 hackbardready for tersoff 3bp debugging
2006-11-30 hackbardvel scaling issues, tersoff still segfaulting!
2006-11-30 hackbardtesting
2006-11-30 hackbardinto the tersoff potential
2006-11-30 hackbardvel scaling fixed/changed
2006-11-30 hackbardtesting
2006-11-29 hackbardfixed create_lattice routine
2006-11-29 hackbardmore foo
2006-11-29 hackbardmore updates -> testing
2006-11-29 hackbardsecurity ci
2006-11-29 hackbardtest
2006-11-28 hackbardwell, no more segfaults -> now its getting hard to...
2006-11-28 hackbardadded sic example code