Skip to content

Issues: iRASPA/RASPA2

New issue

Have a question about this project? Sign up for a free GitHub account to open an issue and contact its maintainers and the community.

Sign up for GitHub

By clicking “Sign up for GitHub”, you agree to our terms of service and privacy statement. We’ll occasionally send you account related emails.

Already on GitHub? Sign in to your account

26 Open 19 Closed
26 Open 19 Closed
Author
Filter by author
Loading
Label
Filter by label
Loading
Use alt + click/return to exclude labels
or ⇧ + click/return for logical OR
Projects
Filter by project
Loading
Milestones
Filter by milestone
Loading
Assignee
Filter by who’s assigned
Sort
Sort by
Newest Oldest Most commented Least commented Recently updated Least recently updated Best match
Most reactions
👍 👎 😄 🎉 😕 ❤️ 🚀 👀

Issues list

Error
#59 opened Nov 27, 2024 by MishaalIrfan
1
INSTALLING RASPA
#58 opened Oct 16, 2024 by Ekugbeunity
Question about force field parameters
#57 opened Sep 23, 2024 by CarvFS
Overestimation of Helium Void Fraction (HVD)
#56 opened Apr 23, 2024 by sofiagrcia
Creating molecules for more systems than the maximum allowed: 1
#55 opened Mar 25, 2024 by zhangshd
2
Warning in Raspa simulation
#54 opened Feb 7, 2024 by khadeeja5858
Installation issue
#50 opened Aug 2, 2023 by thenandirajib
1
Density plot generation - one plot per site instead of one plot per guest?
#48 opened Jul 4, 2023 by BurnerJ
Installation
#41 opened Jun 11, 2023 by ssadman2
1
Partition function for propene
#40 opened Apr 19, 2023 by w-wonder-2023
RASPA for a database
#39 opened Dec 26, 2022 by alireza68hadi
2
Unable to run RASPA2 simulation
#37 opened Sep 3, 2022 by silabrata
1
Installation not working in RASPA2 directory
#36 opened Jun 28, 2022 by sibo
2
Missing molecules/* files ?
#34 opened Feb 24, 2022 by paulboone
commmand not found
#33 opened Dec 30, 2021 by mamadahmadii
Could other potential functions be added into RASPA2? like the ReaxFF potential function.
#32 opened Dec 27, 2021 by tjugonghao
1
The critical temperature, the critical pressure, and the acentric factor of water in TIP5P.def are data of CO2
#30 opened Dec 13, 2021 by johnbbbb
Installation not working with Intel
#29 opened Oct 7, 2021 by sdpb
1
Potential bug installing RASPA in Ubuntu 20.10
#28 opened Sep 14, 2021 by lfsalasg
Error opening input-file
#26 opened Aug 21, 2021 by nk1945
Some provided MOFs are not charge-balanced
#25 opened Jul 21, 2021 by Andrew-S-Rosen
zif 11 and zif 12 structures identical
#24 opened May 26, 2021 by ltalirz
1
Documentation - pdf manual
#17 opened Feb 23, 2021 by MichalTra
4
Charge Equilibration leads to Segmentation Fault
#16 opened Dec 23, 2020 by neumannrf
1
test suite for continuous integration?
#12 opened Dec 19, 2020 by ltalirz
ProTip! Type g p on any issue or pull request to go back to the pull request listing page.