Molcas Forum

Support and discussions for Molcas and OpenMolcas users and developers

You are not logged in.

Announcement

Welcome to the Molcas forum.

Please note: The forum's URL has changed. The new URL is: https://molcasforum.univie.ac.at. Please update your bookmarks!

You can choose an avatar and change the default style by going to "Profile" → "Personality" or "Display".

#1 2025-02-12 09:19:23

wsr1999
Member
Registered: 2023-03-27
Posts: 9

Request for Manual Update to Reflect Recent Features in OpenMolcas

Dear MOLCAS Developers,

I hope this message finds you well.

I’ve been using the OpenMolcas package and noticed some recent updates (such as Intel LLVM support, parallel MS-CASPT2 gradient, etc.), but I observed that the first and second chapters of the manual haven't been updated to reflect these changes. Could you kindly provide any guidance on when these updates might be reflected in the manual? It would be great to have more detailed information on these new features.

Thank you for your hard work on OpenMolcas, and I appreciate your attention to this matter!

Best regards,
Shengrui Wang

Offline

#2 2025-02-12 09:48:11

Ignacio
Administrator
From: Uppsala
Registered: 2015-11-03
Posts: 1,097

Re: Request for Manual Update to Reflect Recent Features in OpenMolcas

Unfortunately, no one is taking care of updating the manual (except for keyword/syntax changes). The best option to follow the changes is the merge requests page on GitLab: https://gitlab.com/Molcas/OpenMolcas/-/ … ge_size=20

Offline

Board footer

Powered by FluxBB 1.5.11

Last refresh: Today 11:57:48