Sharma, S. (author), Balestra, Salvador R.G. (author), Baur, Richard (author), Agarwal, Umang (author), Zuidema, Erik (author), Rigutto, Marcello S. (author), Calero, Sofia (author), Vlugt, T.J.H. (author), Dubbeldam, David (author) We present the RUPTURA code (https://github.com/iraspa/ruptura) as a free and open-source software package (MIT license) for (1) the simulation of gas adsorption breakthrough curves, (2) mixture prediction using methods like the Ideal Adsorption Solution Theory (IAST), segregated-IAST and explicit isotherm models, and (3) fitting of isotherm...
journal article 2023
