GitHub PushEvent at 2014-05-18 21:44:30
Repository: kMC
Actor: jorgehog
Payload: {"shas":[["e1ce73781954e9dc9496aa282a417940cf2ecb97","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","initial rewrite","jorgehog",false],["533e19c3814238b8f6947fc6af952f15ae1d33ce","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","verified that saddle energies calculated are in fact correct.","jorgehog",false],["9a74154d6020f29e8f72d196ea3bfdd0f7345fb4","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","increased the range of the saddle point interaction.","jorgehog",false],["1d54d6f81eec88c2ed0d780c61b55b9ed4fa3360","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","implemented new reaction update flags for new saddle point model","jorgehog",false],["8047234610a4e4b550114d73039bf0c017e5f68f","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","implemented so that adding removing particles now has an increased range\nfor influencing neighbors reactions","jorgehog",false],["cdb734d57e887c7a51478ab0ca9bbe5e9217be95","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","fixed a bug where the last saddle contributors was missing due to a\nmissing = in the comparisons. Fixed a bug where no neighbors was set to\nindicated zero saddle energy. This is no longer known.","jorgehog",false],["4885d004b8c99469162e07480f3b157cc770b987","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","Implemented thuril testing of all saddle energies and their updates.","jorgehog",false],["9751f1e03ba25ffc5f3c1eac5a6f76d75589f45e","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","working on getting all tests to pass (except seq. and knowncase which is\nbroken)","jorgehog",false],["2d6deacf9664d181cdbb5ba5ea49f8df41b87ac6","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","fixed stress test (pun intended)","jorgehog",false],["2f91bdc3087cb7f09850ed757270315d9161f288","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","reaction vector update test updated for new saddle range.","jorgehog",false],["fd7028ed8c605b090569a78dd4b49c626fddffe5","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","there is a bug in resetting the optimized vector test. Need to\ninvestigate. When brute force accuallrate update is performed there is\nno crashes in main solver runs. Need special treatment of round off\nerrors now.","jorgehog",false],["6a95e7de1c9e4c05689fe2cd2ffc5efc91e11dfb","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","all tests but known cases pass. First obstacle overcome. TODO:\nDiagnostics of solver for different parameters.","jorgehog",false],["d75c845d8005ea8d61a62ed1f51c2a7d8c6915d0","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","numerous fixes for allowing sublattice events on the KMC ignis engine.\nHigh temperature seems stable for free solution.","jorgehog",false],["6354afd12156eb97f4a361b812535b7a637f4fc5","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","solver stable for all temperatures. However, can't seem to nucleate any\nlonger.","jorgehog",false],["ca952aa89475fe42df6e647a63e2c43aaea3c665","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","yeah, this does not work anymore. With the wrong sign it worked so well.\nWhat is up with that? Do I need detailed balance?","jorgehog",false],["0887cd9f9caa9c9d8f441249cd4a14ae9d15b414","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","shit just got real. Harmonic transition state theory do NOT work for\nnon-barrier crossing events. For this a simple metropolis monte-carlo\nmove is used. Now we're talking.","jorgehog",false],["08dd407569d71f9eb210108b732fc8fac7cd0c18","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","Divided rate by path length to keep the diffusion constant, well,\n\"constant\". Implemented new rate model for non barrier crossing events.\ncenter crystal behaviour is amazingly well working! Exciting.","jorgehog",false],["8ae77cb8b7fe850171e0de5bd485d6b775205a5f","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","removed symblols flag for release mode","jorgehog",false],["103e84f116a41d0238aada07133402a0409629ed","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","added O3 optimization in linker","jorgehog",false],["7e1e950786154ded7af43600951c55864330754b","09fca6f34bdaae503bead680b3bcb4b44c359621@hotmail.com","added O3 to release mode linker","jorgehog",false]],"size":31,"ref":"refs/heads/master","head":"97630d96864b95c3043169782e5e840c6960c30d"}