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Topic	Forum	Last post
1 Help needed regarding Open_MOLCAS calculations by abid	Running Calculations	Yesterday 15:08:39 by abid
2 MOLCAS 8.0 getpatch by David	Newbie Corner	2019-04-21 09:43:21 by David
3 SCF functional for CASPT2 calculation by daishudaishu	Newbie Corner	2019-03-27 01:57:46 by daishudaishu
4 transition dipole for spin-orbit eigenfunction using RASSI by tumitumi123	Running Calculations	2019-03-22 04:51:33 by tumitumi123
5 Weird RASSI energy by daishudaishu	Running Calculations	2019-02-24 11:15:53 by daishudaishu
6 Getting <lz> value for the ground-state Kramers doublet of Cobalt(II) by Mukesh	Newbie Corner	2019-02-01 14:55:26 by Mukesh
7 angle of the principal anisotropy axes of excited states by nmkit	Running Calculations	2019-01-16 04:50:04 by nmkit
8 the calculation of spin polarization singlet in SCF module by freshman1234	Running Calculations	2018-12-18 02:30:40 by freshman1234
9 Two-electron integrals by chemUTK1	Newbie Corner	2018-12-14 11:07:24 by chemUTK1
10 Seward related error "function has negative norm". Any solution? by Mukesh	Newbie Corner	2018-10-05 10:21:36 by Mukesh
11 Molcas blog by Ignacio	Announcements	2018-09-18 11:50:54 by Ignacio
12 New orbital viewer: Pegamoid by Ignacio	Announcements	2018-09-12 15:10:18 by Ignacio
13 LUSCUS visualisation molecular orbitals by Mohammed Obies	GUI, Tools and Interfaces	2018-08-24 12:38:02 by Mohammed Obies
14 RASSCF convergence issue by Hanros	Running Calculations	2018-08-22 17:49:00 by Hanros
15 Parallel run Openmolcas by Hanros	Parallelization / Clusters	2018-08-16 18:15:20 by Hanros
16 Cmake Error by hrgrimsl	Installation	2018-07-30 15:32:51 by hrgrimsl
17 CASPT2 calculation error by yasuharushiraishi	Running Calculations	2018-07-27 05:19:34 by yasuharushiraishi
18 Hessian extraction by Sarah	Newbie Corner	2018-06-05 17:10:58 by Sarah
19 State for PCM reaction field by fullmetalchem15t	Running Calculations	2018-05-22 17:33:09 by fullmetalchem15t
20 How to get dyson orbital? by tumitumi123	Running Calculations	2018-05-10 21:34:35 by tumitumi123
21 casscf for CH3I+ Problems in orbital optimization by tumitumi123	Newbie Corner	2018-04-27 03:19:20 by tumitumi123
22 LUSCUS to display the difference between two densities by Sarah	GUI, Tools and Interfaces	2018-04-01 17:03:15 by Sarah
23 Energy components in CASSCF by SebastianS	Newbie Corner	2018-03-15 14:57:51 by SebastianS
24 excited states -HEXS by Hanros	Newbie Corner	2018-02-27 13:17:04 by Hanros
25 Cho_X_Init failed when trying MC-PDFT by shuoshuo	Running Calculations	2018-02-27 07:10:45 by shuoshuo
26 CIRoot calculation error by Hanros	Newbie Corner	2018-02-07 12:51:42 by Hanros
27 using internal coordinates (in a seperate file) by oferyko	Newbie Corner	2018-01-18 11:59:25 by oferyko
28 Error in gateway by freshman1234	Running Calculations	2018-01-09 13:43:51 by freshman1234
29 ERROR obtained by rizwan	Newbie Corner	2017-12-20 10:34:25 by rizwan
30 Problem with choosing the right active space by ordinaryboy	Newbie Corner	2017-12-15 13:37:11 by ordinaryboy

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