General

RUPTURA - fitting file

Started by inangoi

Replies: 0
Views: 665

July 10, 2024, 01:57:45 PM
by inangoi

RASPA 2.0 vs RASPA 2.0.45

Started by rshukre

Replies: 0
Views: 2,497

September 29, 2021, 08:46:07 PM
by rshukre

Can anyone recommend some literatures about GCMC simulation？

Started by WuJH

Replies: 0
Views: 1,464

December 21, 2023, 04:03:29 PM
by WuJH

PSD of Zeolitic systems with mobile cations

Started by AHF

Replies: 0
Views: 2,447

November 26, 2021, 07:06:10 PM
by AHF

Problems on Compiling RASPA2

Started by LHZF

Replies: 0
Views: 2,204

May 01, 2021, 10:10:58 PM
by LHZF

Inquiry regarding RASPA calculations -Chemical potential and Number of molecules

Started by Temoor

Replies: 0
Views: 1,575

September 28, 2023, 06:26:45 PM
by Temoor

Installation on ubuntu

Started by Aleksandr Volkov

Replies: 0
Views: 1,795

March 09, 2024, 11:48:36 AM
by Aleksandr Volkov

RxMC ensemble

Started by Mohammad Ahmadi

Replies: 0
Views: 1,466

June 13, 2023, 08:15:32 AM
by Mohammad Ahmadi

Energy Drift - Cations

Started by isaaraujo

Replies: 0
Views: 2,470

January 08, 2022, 09:52:04 AM
by isaaraujo

Difficult to install RASPA3 on Ubuntu 22.04

Started by Yu_Zhuochen

Replies: 0
Views: 459

June 20, 2024, 12:10:33 PM
by Yu_Zhuochen

Quantitative density profile in a small pore.

Started by Temoor

Replies: 0
Views: 1,475

September 14, 2023, 07:34:10 PM
by Temoor

How to change the atom index in the CIF.file to the format that Raspa can read ?

Started by kokojiang

Replies: 0
Views: 1,519

October 24, 2023, 06:56:23 AM
by kokojiang

Mismatch between experimental and modelled data - forcefields?

Started by Xaiver

Replies: 0
Views: 1,495

April 04, 2023, 03:12:19 AM
by Xaiver

Density Histogram from GCMC simulation for four-component gasmixture adsorption

Started by Cigdem

Replies: 0
Views: 1,633

August 16, 2023, 08:32:36 AM
by Cigdem

helium void fraction

Started by alireza_hadi68

Replies: 1
Views: 83

September 07, 2024, 05:50:58 AM
by Lingxiao Qin

Run RASPA using MPI

Started by manuelbenavent

Replies: 1
Views: 3,007

August 20, 2020, 12:13:30 PM
by dubbelda

Mg and K cations .def file

Started by ergrhn

Replies: 1
Views: 2,957

May 26, 2020, 05:57:06 PM
by David Dubbeldam

Raspa on Windows

Started by OliverD

Replies: 1
Views: 2,358

May 05, 2021, 01:46:40 PM
by David Dubbeldam

Running RASPA2 with Python Scripts

Started by Busra

Replies: 1
Views: 3,013

August 20, 2020, 12:09:36 PM
by David Dubbeldam

net charge warning

Started by Monica_Gao

Replies: 1
Views: 4,014

July 14, 2020, 12:51:32 PM
by dubbelda