KiSThelP website

KiSThelP - a program to predict thermodynamic properties and rate constants from quantum chemistry results.


Frequently Asked Questions

  1. On double-clicking on the Kisthelp java icon (kisthelpXXXX.jar), it causes the file to be opened in the archive manager instead of being executed: right-click the icon and select to open it with the JRE ("Java Runtime Environment")
  2. The program always freezes when I do TST calculations when reading frequencies values : The imaginary frequency must be entered as "3000i" and not "-3000" in the .kinp input file. Whenever possible, the best is to let KiSThelP read the quantum chemistry outputfile (Gaussian, NWCHEM, Gamess).

______________________________________________________________________________________________