Compiling NWChem

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Locked Sticky: NWChem 6.8 available for dowload Started By : Edoapra	0	2162	Dec 14th 1:51 pm Edoapra

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Thread Title	Replies	Views	Last Action
How to recompile nwchem 6.6. Started By : Bikash Patra	0	751	Jan 25th 12:04 am Bikash Patra
compiling on centos~~ can't find Python.h Started By : Zww9	10	1962	Jan 18th 11:36 am Zww9
Failure to compile on MinGW with MSYS Started By : Covalent	3	1942	Jan 17th 9:59 am Edoapra
Error in ccsd_t after compiling Started By : MarcelB	3	925	Jan 8th 2:13 pm Jhammond
"Catastrophic error" on ccsd_t_kernels_omp.F when compiling nw6.6 by ifort 15.0.2 under CentOS 7 Started By : Vistawanted	3	1124	Jan 4th 6:23 pm Edoapra
Error compiling mov2asc in opensuse Started By : Jecerca	1	734	Dec 27th 5:16 pm Edoapra
Compiling on RHEL 7 with MKL1 2 Started By : Afeleut	21	5307	Dec 27th 5:11 pm Edoapra
configure: error: test for ARMCI_NETWORK=OPENIB failed Started By : Rangsiman	0	748	Dec 13th 4:44 am Rangsiman
Intel E5-2640v3 Haswell: No such instruction Started By : Danielk	4	2167	Dec 12th 12:04 am Danielk
error in compilation with gfortran 5.4.0, -march=native Started By : Ylniu	4	996	Dec 10th 7:08 pm Ylniu
MRCC_METHODS vs MRCC_THEORY Started By : Vladimir	3	931	Dec 7th 2:55 pm Edoapra
Nwchem 6.6 - CentOS 7.2 Started By : Jwkeller	1	956	Nov 26th 12:39 pm Jwkeller
-lcc_dynamic missing on latest Mac Started By : Jhammond	4	945	Sep 22nd 11:10 am Jhammond
using FOPTIMIZE Started By : Jhammond	0	773	Sep 21st 7:30 pm Jhammond
CCSDTLR Not Compiled Error in Example ccsdt_polar_small.nw1 2 Started By : Xiongyan21	28	11588	Sep 21st 2:36 pm Jhammond
NWChem 6.6 Compiling on Cray: FTN Recursive Include Error Started By : Pyswagoras	3	1001	Sep 21st 2:13 pm Jhammond
NWCHEM 6-6 on Mageia 5 Started By : Alfcanova	1	938	Sep 21st 2:07 pm Jhammond
nwchem-6.6 compilation error from source Started By : Neo	6	1060	Sep 21st 2:22 am Neo
why nwchem_6.0 crashes in parallel run Started By : Neo	2	798	Sep 14th 8:05 pm Neo
NWChem seg fault crashes on Centos 7.2 Started By : Deej	10	2264	Sep 1st 4:46 pm Jdmoore2004
NWChem in Spack package manager Started By : Den59	0	913	Aug 29th 6:25 am Den59
NWChem 6.3 library containing MPI_Init no Started By : Andrew	4	932	Aug 25th 8:28 am Edoapra
NWChem 6.6: util_getppn.patch is already partly applied Started By : Den59	1	905	Aug 23rd 8:02 am Edoapra
NWChem 6.6 for BlueGene/Q Started By : Chiensh	15	2785	Aug 10th 9:49 pm Buchwj
NWChem 6.6 compilation fails on mac Started By : Nevensky	5	1051	Aug 8th 3:45 pm Edoapra

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