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Topic	Forum	Last post
1 angle of the principal anisotropy axes of excited states by nmkit	Running Calculations	2019-01-16 04:50:04 by nmkit
2 the calculation of spin polarization singlet in SCF module by freshman1234	Running Calculations	2018-12-18 02:30:40 by freshman1234
3 Two-electron integrals by chemUTK1	Newbie Corner	2018-12-14 11:07:24 by chemUTK1
4 Seward related error "function has negative norm". Any solution? by Mukesh	Newbie Corner	2018-10-05 10:21:36 by Mukesh
5 Molcas blog by Ignacio	Announcements	2018-09-18 11:50:54 by Ignacio
6 New orbital viewer: Pegamoid by Ignacio	Announcements	2018-09-12 15:10:18 by Ignacio
7 LUSCUS visualisation molecular orbitals by Mohammed Obies	GUI, Tools and Interfaces	2018-08-24 12:38:02 by Mohammed Obies
8 RASSCF convergence issue by Hanros	Running Calculations	2018-08-22 17:49:00 by Hanros
9 Parallel run Openmolcas by Hanros	Parallelization / Clusters	2018-08-16 18:15:20 by Hanros
10 Cmake Error by hrgrimsl	Installation	2018-07-30 15:32:51 by hrgrimsl
11 CASPT2 calculation error by yasuharushiraishi	Running Calculations	2018-07-27 05:19:34 by yasuharushiraishi
12 Hessian extraction by Sarah	Newbie Corner	2018-06-05 17:10:58 by Sarah
13 State for PCM reaction field by fullmetalchem15t	Running Calculations	2018-05-22 17:33:09 by fullmetalchem15t
14 How to get dyson orbital? by tumitumi123	Running Calculations	2018-05-10 21:34:35 by tumitumi123
15 casscf for CH3I+ Problems in orbital optimization by tumitumi123	Newbie Corner	2018-04-27 03:19:20 by tumitumi123
16 LUSCUS to display the difference between two densities by Sarah	GUI, Tools and Interfaces	2018-04-01 17:03:15 by Sarah
17 Energy components in CASSCF by SebastianS	Newbie Corner	2018-03-15 14:57:51 by SebastianS
18 excited states -HEXS by Hanros	Newbie Corner	2018-02-27 13:17:04 by Hanros
19 Cho_X_Init failed when trying MC-PDFT by shuoshuo	Running Calculations	2018-02-27 07:10:45 by shuoshuo
20 CIRoot calculation error by Hanros	Newbie Corner	2018-02-07 12:51:42 by Hanros
21 using internal coordinates (in a seperate file) by oferyko	Newbie Corner	2018-01-18 11:59:25 by oferyko
22 Error in gateway by freshman1234	Running Calculations	2018-01-09 13:43:51 by freshman1234
23 ERROR obtained by rizwan	Newbie Corner	2017-12-20 10:34:25 by rizwan
24 Problem with choosing the right active space by ordinaryboy	Newbie Corner	2017-12-15 13:37:11 by ordinaryboy
25 MRCISD incosistency problem by freshman1234	Running Calculations	2017-12-14 07:48:45 by freshman1234
26 Convergence problem by sourav	Newbie Corner	2017-12-12 16:19:33 by sourav
27 Problem when running SURFACEHOP task by shuoshuo	Running Calculations	2017-11-15 13:42:09 by shuoshuo
28 Printing of the AO overlap matrix by Robertpolly	Running Calculations	2017-11-13 08:05:55 by Robertpolly
29 MRCI natural orbitals by sourav ghoshal	Running Calculations	2017-11-11 11:15:55 by sourav ghoshal
30 Can anyone check my MRCI input file? I got an unexpected result. by sourav ghoshal	Running Calculations	2017-11-03 07:31:56 by sourav ghoshal

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