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
Error when compiling NWchem 6.8	1	1393	Jun 4th 10:35 am Edoapra
Compiling NWChem 6.8.1 on ARCHER using Intel	5	1724	Apr 25th 10:58 am Gh3orghiu
A request for help1 2	19	6800	Apr 16th 4:50 pm 4rhanes
Compilation of NWCHEM6.8 Fails on Ubuntu17.10.2 with MPICH 3.3a2	1	994	Apr 6th 7:23 pm Xiongyan21
Compiling/Running NWChem 6.8.1 over Intel Omni-Path and NVidia P100 offload	1	1364	Apr 2nd 10:01 am Edoapra
Testing NWChem installation for correctness	4	1628	Mar 29th 7:45 am Chrisn77
Compiling NWChem Ubuntu 17.10	2	1791	Mar 28th 3:27 am Rangsiman
Compiling NWChem fails on Ubuntu 16.04	1	1299	Mar 26th 4:27 pm Edoapra
Problem compiling on Mac OS 10.13	7	3091	Mar 1st 9:45 am Easy Cheese
NWChem 6.6 -segmentation fault	12	2277	Feb 16th 10:26 am Edoapra
USE_MPIF4=y	1	838	Feb 14th 11:59 am Bylaska
64bit Integers	2	790	Feb 14th 2:14 am Jasno
NWChem 6.8: Compilation error in libtce.a(ccsd_t.o) for Intel Phi KNC	4	1626	Feb 7th 4:05 am Jskennyu
Compile Ubuntu	1	1003	Jan 31st 10:58 am Edoapra
Ubuntu 14.04 - inconsistent data on presence of BLAS library	1	974	Jan 26th 6:20 pm Edoapra
MEMKIND for FASTMEM	1	1066	Jan 19th 12:34 pm Edoapra
USE_FASTMEM=F on KNL	0	831	Jan 16th 11:36 pm Chiensh
Ubuntu Root Password Blocks Running NWChem6.8	1	1043	Jan 14th 2:00 am Xiongyan21
Compiling Ubuntu 17.10	2	896	Jan 13th 5:48 pm Diego paschoal
An attempt to run as root problem encounted by NWCHEM on Ubuntu17.10	1	1641	Jan 11th 6:34 am Xiongyan21
NWCHEM6.8 Has Been Successfully Built on macOS High Sierra with MPICH2 3.2.1	0	974	Jan 8th 8:33 pm Xiongyan21
Compilation of NWCHEM6.8 Failed on macOS High Sierra with Openmpi 3.0.0_1	0	1071	Jan 7th 8:06 pm Xiongyan21
NWChem 6.6: MA fatal error: MA_sizeof: invalid datatype (macOS)	13	2748	Dec 27th 10:02 pm Jhammond
Second Official Candidate Release of NWCHEM6.8 cannot be compiled on Ubuntu17.10	8	2734	Dec 6th 6:15 am Xiongyan21
Official Candidate Release of NWCHEM6.8 cannot be compiled on MAC	12	1998	Nov 21st 9:47 pm Xiongyan21
Compile only TCE part in NWChem	1	972	Nov 3rd 12:11 pm Edoapra

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