Evgenii B. Rudnyi
Documentation, Download (manual included)
If you have been redirected from http://www.chem.msu.ru/~rudnyi/tdlib/*.html, look at the documentation.
This is TDLIB'00+, an updated version of TDLIB'00. I have fixed the code and now it can be compiled with gcc 3.3, at least on my Mac and on Windows with cygwin. If you need a binary, let me know.
tdlib was my major programming project from 1995 to 2000. Its
feature was XML-like external representation for the developed classes. This
was an effort to make a uniform computational framework for computational
chemical thermodynamics. On one side, there were several iterations after species, on another, a new
version of varcomp. The main
drawback is that there is still
no good solver to compute equilibrium in a multiphase system. Currently, this
is possible only when co-existing phases are given. Originally to this end, I
planned to generalize bacuy_eq, but I
did not have time to accomplish it. It happened that for inverse tasks this
was not the the major problem as one usually knows co-existing phases in this
See publications where TDLIB has been used.
See also: Experimental Datasets from Chemical Thermodynamics.