Py-ChemShell

Topic / Topic starter Replies Last postsort ascending
Normal topic Adding D3 dispersion correcting with ORCA interface
by asoyemi » Mon, 17/01/2022 - 17:29
3
by asoyemi
Mon, 17/01/2022 - 17:47
Normal topic Run error
by jctc » Fri, 14/01/2022 - 10:23
3
by ylu
Mon, 17/01/2022 - 17:15
Normal topic Creating clusters from cif files
by asoyemi » Fri, 14/01/2022 - 16:41
0
by asoyemi
Fri, 14/01/2022 - 16:41
Normal topic Visualize optimized geometry from DL_FIND optimization
by asoyemi » Fri, 14/01/2022 - 00:56
1
by tomkeal
Fri, 14/01/2022 - 15:02
Normal topic Segmentation Error
by sairamadugu » Mon, 30/08/2021 - 18:19
1
by sairamadugu
Mon, 30/08/2021 - 20:39
Normal topic ChemShell-NWchem multiprocessors error.
by chenxin » Sat, 07/08/2021 - 03:03
2
by ylu
Tue, 17/08/2021 - 06:33
Normal topic py-ChemShell gulp questionnaire
by Sang Il Han » Tue, 01/06/2021 - 12:15
1
by tomkeal
Mon, 07/06/2021 - 13:14
Normal topic ChemShell cannot find NumPy
by guanw » Tue, 20/04/2021 - 18:11
2
by guanw
Thu, 29/04/2021 - 15:14
Normal topic py-ChemShell GULP Error
by vrahul » Wed, 17/02/2021 - 03:45
2
by vrahul
Thu, 18/02/2021 - 11:31
Normal topic Overall charge is different for ORCA and NWChem QM interfaces in MgO surface
by Benjamin Shi » Thu, 04/02/2021 - 16:24
3
by Benjamin Shi
Mon, 15/02/2021 - 21:55
Normal topic Incorrect Fragment loaded from large CJSON
by max » Thu, 27/08/2020 - 09:56
1
by ylu
Tue, 12/01/2021 - 22:37
Normal topic segfault due to memory mismatch.
by Levi Keller » Sat, 03/10/2020 - 16:19
1
by ylu
Tue, 12/01/2021 - 22:16
Normal topic Support for DFTB+
by chae0603 » Thu, 05/11/2020 - 06:35
1
by tomkeal
Tue, 10/11/2020 - 12:13
Normal topic Error is setup script
by Levi Keller » Sat, 03/10/2020 - 15:46
0
by Levi Keller
Sat, 03/10/2020 - 15:46
Normal topic segmentation fault occurred
by wenjian » Mon, 20/07/2020 - 08:26
2
by wenjian
Mon, 31/08/2020 - 11:24
Normal topic MKL issue with statically linked libraries
by Levi Keller » Thu, 02/07/2020 - 10:20
1
by ylu
Mon, 27/07/2020 - 17:07
Normal topic Py-ChemShell Compile Error with GULP
by shaychaudhuri » Tue, 10/12/2019 - 09:37
0
by shaychaudhuri
Tue, 10/12/2019 - 09:37
Normal topic dl_py2f error
by mspichty » Thu, 09/05/2019 - 10:01
1
by tomkeal
Thu, 09/05/2019 - 17:06
Normal topic Chemshell compile fail with gcc
by RagnarB » Tue, 02/04/2019 - 16:25
4
by ylu
Mon, 15/04/2019 - 16:32
Normal topic Platform related failure?
by asmunroh » Wed, 27/03/2019 - 08:20
1
by ylu
Mon, 01/04/2019 - 16:24
Normal topic DL_FIND Error
by saikat403 » Mon, 25/02/2019 - 10:09
1
by tomkeal
Mon, 25/02/2019 - 16:16
Normal topic Setup fails at 41%
by codyaldaz » Mon, 08/10/2018 - 05:30
1
by tomkeal
Mon, 08/10/2018 - 10:41
New posts
No new posts
Hot topic with new posts
Hot topic without new posts
Sticky topic
Locked topic
Subscribe to RSS - Py-ChemShell