15
Jan
Second official release COLSCAT2d is now available.
Added Features -Now Handles 2-state systems -User defined boundary conditions -Included examples F+HCl and F+H2 with spin-orbit coupling
colscat2.0.zip version 2.0 zip archive (1/15/15)
1
Apr
First official release COLSCAT2d.
Features -Sparse, vectorized MATLAB routines = FAST -Gradient approximation for data defined on triangulated meshes -Automatic mesh generation (using Persson/Strang's distmesh2d) -Automated minimum energy path locator -Can handle any 1D (along reaction path) or 2D (collinear) atom+diatom reactions -Example systems H+H2, F+H2, F+HCl with PES routines
colscat1.0.zip version 1.0 zip archive (3/1/14)