General

Mismatch between experimental and modelled data - forcefields?

Started by Xaiver

Replies: 0
Views: 5,059

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

Inquiry regarding RASPA calculations -Chemical potential and Number of molecules

Started by Temoor

Replies: 0
Views: 6,259

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

Density Histogram from GCMC simulation for four-component gasmixture adsorption

Started by Cigdem

Replies: 0
Views: 5,938

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

Problems on Compiling RASPA2

Started by LHZF

Replies: 0
Views: 5,592

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

RxMC ensemble

Started by Mohammad Ahmadi

Replies: 0
Views: 5,424

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

Difficulty installing iraspa

Started by kareems

Replies: 0
Views: 3,270

April 20, 2025, 06:05:34 PM
by kareems

Heat of adsorption calculation problem

Started by SEB

Replies: 0
Views: 3,218

June 10, 2025, 05:18:41 PM
by SEB

Error with RASPA2 with 5185 atoms model

Started by sree.h

Replies: 0
Views: 3,128

April 22, 2025, 11:50:05 AM
by sree.h

Installation on ubuntu

Started by Aleksandr Volkov

Replies: 0
Views: 5,821

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

Henrys Constant output

Started by bphan

Replies: 0
Views: 6,537

June 23, 2022, 07:46:06 PM
by bphan

Quantitative density profile in a small pore.

Started by Temoor

Replies: 0
Views: 5,848

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

Can anyone recommend some literatures about GCMC simulation？

Started by WuJH

Replies: 0
Views: 5,489

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

Energy Drift - Cations

Started by isaaraujo

Replies: 0
Views: 6,399

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

Matrix Inversion, Gauss-Jordan: Singular Matrix Problem

Started by Auri

Replies: 0
Views: 3,523

June 24, 2025, 11:14:23 AM
by Auri

PSD of Zeolitic systems with mobile cations

Started by AHF

Replies: 0
Views: 6,286

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

The name of RASPA

Started by sara abbasi

Replies: 0
Views: 5,679

March 18, 2024, 08:07:55 PM
by sara abbasi

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

Started by kokojiang

Replies: 0
Views: 5,863

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

Difficult to install RASPA3 on Ubuntu 22.04

Started by Yu_Zhuochen

Replies: 0
Views: 6,034

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

RASPA 2.0 vs RASPA 2.0.45

Started by rshukre

Replies: 0
Views: 6,670

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

Surface area of MgMOF-74

Started by imaeda

Replies: 1
Views: 7,406

August 20, 2020, 12:04:39 PM
by dubbelda