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How to define cations positon from CIF but hold its "cation attribute" in RASPA

Started by ykz

Replies: 3
Views: 7,121

January 16, 2020, 06:15:21 PM
by David Dubbeldam

Flexible-MOFs forcefield Issue

Started by YangLZ

Replies: 4
Views: 6,539

January 16, 2020, 06:13:10 PM
by David Dubbeldam

Using RASPA for Nanocarbons

Started by Maxim N. Popov

Replies: 1
Views: 5,981

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

Parallelization of RASPA simulations with Golem

Started by nowakoww

Replies: 1
Views: 9,210

January 25, 2019, 03:59:37 PM
by nowakoww

GCMC results not exactly matching with literature

Started by Vardhan

Replies: 2
Views: 6,628

December 04, 2018, 11:49:26 AM
by Vardhan

'CrashRestart' taking long time

Started by Vardhan

Replies: 5
Views: 9,696

December 04, 2018, 10:18:32 AM
by David Dubbeldam

Issue with the forcefield

Started by sridhar

Replies: 3
Views: 8,759

September 21, 2018, 05:44:04 PM
by David Dubbeldam