Compiling NWChem

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Locked Sticky: NWChem 6.8 available for dowload Started By : Edoapra	0	2163	Dec 14th 1:51 pm Edoapra

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Thread Title	Replies	Views	Last Action
Compiling NWChem 6.8.1 on ARCHER using Intel Started By : Gh3orghiu	5	576	Apr 25th 9:58 am Gh3orghiu
A request for help1 2 Started By : Jason York	19	4137	Apr 16th 3:50 pm 4rhanes
Compilation of NWCHEM6.8 Fails on Ubuntu17.10.2 with MPICH 3.3a2 Started By : Xiongyan21	1	476	Apr 6th 6:23 pm Xiongyan21
Compiling/Running NWChem 6.8.1 over Intel Omni-Path and NVidia P100 offload Started By : Jskennyu	1	596	Apr 2nd 9:01 am Edoapra
Testing NWChem installation for correctness Started By : Luiceur	4	787	Mar 29th 6:45 am Chrisn77
Compiling NWChem Ubuntu 17.10 Started By : Diego paschoal	2	857	Mar 28th 2:27 am Rangsiman
Compiling NWChem fails on Ubuntu 16.04 Started By : Anhvt89	1	664	Mar 26th 3:27 pm Edoapra
Problem compiling on Mac OS 10.13 Started By : Easy Cheese	7	1135	Mar 1st 8:45 am Easy Cheese
windows 10 64 Started By : P99	5	931	Feb 26th 8:33 am Hockswender
6.8 on Windows Started By : P99	1	683	Feb 16th 11:54 am Edoapra
NWChem 6.6 -segmentation fault Started By : Akrish	12	1236	Feb 16th 9:26 am Edoapra
USE_MPIF4=y Started By : Jasno	1	363	Feb 14th 10:59 am Bylaska
64bit Integers Started By : Jasno	2	341	Feb 14th 1:14 am Jasno
NWChem 6.8: Compilation error in libtce.a(ccsd_t.o) for Intel Phi KNC Started By : Jskennyu	4	787	Feb 7th 3:05 am Jskennyu
Compile Ubuntu Started By : Diego paschoal	1	502	Jan 31st 9:58 am Edoapra
Ubuntu 14.04 - inconsistent data on presence of BLAS library Started By : Shanecentre	1	487	Jan 26th 5:20 pm Edoapra
MEMKIND for FASTMEM Started By : Chiensh	1	471	Jan 19th 11:34 am Edoapra
USE_FASTMEM=F on KNL Started By : Chiensh	0	353	Jan 16th 10:36 pm Chiensh
Ubuntu Root Password Blocks Running NWChem6.8 Started By : Xiongyan21	1	517	Jan 14th 1:00 am Xiongyan21
Compiling Ubuntu 17.10 Started By : Diego paschoal	2	423	Jan 13th 4:48 pm Diego paschoal
An attempt to run as root problem encounted by NWCHEM on Ubuntu17.10 Started By : Xiongyan21	1	559	Jan 11th 5:34 am Xiongyan21
NWCHEM6.8 Has Been Successfully Built on macOS High Sierra with MPICH2 3.2.1 Started By : Xiongyan21	0	448	Jan 8th 7:33 pm Xiongyan21
Compilation of NWCHEM6.8 Failed on macOS High Sierra with Openmpi 3.0.0_1 Started By : Xiongyan21	0	558	Jan 7th 7:06 pm Xiongyan21
NWChem 6.6: MA fatal error: MA_sizeof: invalid datatype (macOS) Started By : Den59	13	1757	Dec 27th 9:02 pm Jhammond
Second Official Candidate Release of NWCHEM6.8 cannot be compiled on Ubuntu17.10 Started By : Xiongyan21	8	1113	Dec 6th 5:15 am Xiongyan21

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