iRASPA Community

RASPA => Input files and parameters => Topic started by: peter on July 05, 2022, 04:10:13 PM

Title: Idealgasrosenbluchweight
Post by: peter on July 05, 2022, 04:10:13 PM
Hi, I hope you are all doing well. Just short question.
At particular temperature, we need to compute idealgasrosenbluvhweight for cbmc. Is this parameter
The same for bulk and confined fluid ? If not it must be recalculated for all porous materials ? Cheers piotr

Title: Re: Idealgasrosenbluchweight
Post by: David Dubbeldam on July 14, 2022, 07:43:34 PM
The ideal gas Rosenbluth weight is only depending on temperature. For each temperature you can pre-compute it (see examples).
Title: Re: Idealgasrosenbluchweight
Post by: peter on July 16, 2022, 01:00:43 PM
Thank you for answer. I followed the published example. The EOS for n hexane is reproduced from TRAPPE. Regards Piotr