General

Using RASPA for Nanocarbons

Started by Maxim N. Popov

Replies: 1
Views: 37,939

July 06, 2019, 04:36:59 PM
by David Dubbeldam

Error at run time

Started by chenglong

Replies: 1
Views: 36,278

May 21, 2021, 06:47:00 PM
by David Dubbeldam

Run RASPA using MPI

Started by manuelbenavent

Replies: 1
Views: 42,005

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

Surface area of MgMOF-74

Started by imaeda

Replies: 1
Views: 42,331

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

Warning: Reinsertion used on the charged ions

Started by Monica_Gao

Replies: 1
Views: 38,667

January 07, 2021, 08:02:11 PM
by David Dubbeldam

Enthalpy of adsorption for binary mixture

Started by AHF

Replies: 1
Views: 39,305

March 14, 2022, 07:13:39 PM
by David Dubbeldam

Raspa on Windows

Started by OliverD

Replies: 1
Views: 35,220

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

Running RASPA2 with Python Scripts

Started by Busra

Replies: 1
Views: 37,550

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

parameter input

Started by sfritzsche

Replies: 1
Views: 36,397

June 08, 2021, 02:36:34 PM
by David Dubbeldam

net charge warning

Started by Monica_Gao

Replies: 1
Views: 41,408

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

NPT Simulations

Started by isaaraujo

Replies: 1
Views: 37,529

December 02, 2021, 10:48:39 AM
by David Dubbeldam

Mg and K cations .def file

Started by ergrhn

Replies: 1
Views: 36,757

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

Problem with pressure calculations during adsorption

Started by Temoor

Replies: 2
Views: 44,453

June 13, 2023, 12:47:02 PM
by David Dubbeldam

Why the excess adsorption is negative, absolute adsorption is zero when doing MC

Started by YadiJiang

Replies: 2
Views: 45,028

December 09, 2021, 08:06:45 AM
by sara abbasi

NPT-Flexible framework

Started by isaaraujo

Replies: 2
Views: 44,751

December 01, 2021, 04:29:31 PM
by isaaraujo

list of configurational moves in .def file

Started by ae213

Replies: 2
Views: 44,879

June 23, 2022, 06:17:44 PM
by ae213

ForceField Parameter for Carbon

Started by cud

Replies: 2
Views: 40,952

March 06, 2021, 11:01:15 PM
by cud

The Tail-Correction in RASPA

Started by fjoodaki

Replies: 2
Views: 39,697

March 02, 2021, 12:55:11 AM
by fjoodaki

Very beginner question

Started by extremesonic01

Replies: 2
Views: 46,439

June 13, 2023, 12:40:19 PM
by David Dubbeldam

Issue with ExtraFrameworkMolecule

Started by Kajum Safiullin

Replies: 2
Views: 41,541

December 25, 2020, 11:41:41 AM
by Kajum Safiullin