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
Undefined references for nwchem6.6 on ubuntu 16.04	2	1514	Apr 25th 10:07 pm Jhelfferich
NWChem 6.6 gfortran+MKL	0	1112	Apr 15th 3:33 am Dishu1
Compilation with OpenMPI	9	2009	Apr 7th 11:10 am Edoapra
nwchem not running in IBM ppc64 le	0	921	Apr 3rd 6:41 am Tamalgoswami
Improper compilation causes memory error during running nwchem	13	3833	Mar 1st 3:02 am DanChQ
Problem in running NWChem.	3	1705	Feb 27th 11:03 am Bikash Patra
MPI errors Centos 7.3	4	2392	Feb 8th 12:25 pm Deej
NWChem is successfully built on mac OS Sierra10.12.3 with GCC6.3.0 and mpich3.2_2.	0	1260	Feb 2nd 4:06 am Xiongyan21
How to recompile nwchem 6.6.	0	1141	Jan 25th 1:04 am Bikash Patra
compiling on centos~~ can't find Python.h	10	2986	Jan 18th 12:36 pm Zww9
Failure to compile on MinGW with MSYS	3	2458	Jan 17th 10:59 am Edoapra
Error in ccsd_t after compiling	3	1496	Jan 8th 3:13 pm Jhammond
"Catastrophic error" on ccsd_t_kernels_omp.F when compiling nw6.6 by ifort 15.0.2 under CentOS 7	3	1922	Jan 4th 7:23 pm Edoapra
Error compiling mov2asc in opensuse	1	1110	Dec 27th 6:16 pm Edoapra
Compiling on RHEL 7 with MKL1 2	21	8055	Dec 27th 6:11 pm Edoapra
configure: error: test for ARMCI_NETWORK=OPENIB failed	0	1215	Dec 13th 5:44 am Rangsiman
Intel E5-2640v3 Haswell: No such instruction	4	4199	Dec 12th 1:04 am Danielk
error in compilation with gfortran 5.4.0, -march=native	4	1427	Dec 10th 8:08 pm Ylniu
MRCC_METHODS vs MRCC_THEORY	3	1358	Dec 7th 3:55 pm Edoapra
Nwchem 6.6 - CentOS 7.2	1	1414	Nov 26th 1:39 pm Jwkeller
-lcc_dynamic missing on latest Mac	4	1460	Sep 22nd 12:10 pm Jhammond
using FOPTIMIZE	0	1256	Sep 21st 8:30 pm Jhammond
CCSDTLR Not Compiled Error in Example ccsdt_polar_small.nw1 2	28	14179	Sep 21st 3:36 pm Jhammond
NWChem 6.6 Compiling on Cray: FTN Recursive Include Error	3	1528	Sep 21st 3:13 pm Jhammond
NWCHEM 6-6 on Mageia 5	1	1535	Sep 21st 3:07 pm Jhammond
nwchem-6.6 compilation error from source	6	1701	Sep 21st 3:22 am Neo

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