Compiling NWChem

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Locked Sticky: Website shutting down on July 31st 2020. Moving to google groups	0	1715	Jun 18th 5:01 pm Edoapra
Locked Sticky: NWChem 7.0.0 available for dowload	0	13620	Dec 14th 2:51 pm Edoapra

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Thread Title	Replies	Views	Last Action
Compiling NwChem 6.8.1 on Ubuntu 18.04 with OpenMPI 4.0 failed	13	1893	Apr 13th 10:06 am Edoapra
Compiling NWChem 7	4	326	Apr 7th 8:44 pm Diego paschoal
Compilation of NWCHEM7.0.0 is successful on Ubuntu18.04	7	313	Mar 29th 3:21 am Xiongyan21
undefined reference to `MPI_Errhandler_set'	2	317	Feb 20th 12:47 am MoritzBraun
Compiling NWChem on CentOS 8?	1	459	Feb 3rd 11:43 am Edoapra
Can't find MKL routines during compilation on CentOS 7 cluster	4	657	Feb 3rd 11:23 am Epj
No rule to make NWCHEM target	2	492	Jan 29th 3:27 am Xiongyan21
Problem with USE_OFFLOAD	12	558	Jan 27th 8:14 am Epj
Compiling NWChem 6.8.1 on Mellanox Infiniband cluster with GNU compilers and Intel MPI and MKL	5	404	Jan 15th 9:16 pm Valtandor
FYI: build_nwchem error	0	391	Dec 23rd 9:12 am Epj
NWChem Compilation Issues in the Cluster Solved	0	556	Nov 17th 11:55 am Tan294
lmpiblacs problems while compiling on Centos HPC	6	525	Nov 6th 9:30 am Bradjac2
NWChem error	1	416	Nov 5th 11:15 am Edoapra
Compiling with modified global.util.c	1	401	Nov 4th 5:25 pm Jmk12
Compiling NWCHEM on Ubuntu 12.04.2 LTS (not as administrator)1 2	20	2034	Oct 28th 7:29 pm John1234
Compiling 6.8 on Ubuntu 16.04 with GPU	1	967	Oct 8th 8:39 pm VA-QM
Compiling 6.8.1 on CentOS Cluster with OpenMPI	1	654	Oct 8th 9:13 am Edoapra
libtool & link problem	1	605	Sep 15th 2:59 am Miro ilias
v6.8.1 error in ddot intel compiler	3	762	Jul 18th 9:39 am Edoapra
6.8 on Windows	3	1858	Jul 12th 10:58 am Edoapra
Compiling Venus- NWChem 6.8.1 -Undefined Reference Error!	0	510	Jun 24th 2:50 pm Hackneyed
code exiting after 'entering davidson iterations'	1	600	Jun 13th 1:29 am Elena
Can EA(IP)-EOM-CCSDT(CCSDTQ) methods be exported in NWCHEM?	0	705	Feb 21st 7:56 pm Xiongyan21
NWCHEM6.8 can run on macOS Mojave 10.14.3	0	711	Feb 14th 4:58 am Xiongyan21
Compiling NWChem 6.8 on CentOS 7.4 - problems w kernel 3.10.0-693.17.1	5	1532	Feb 11th 12:13 pm Jwkeller

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