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{phys}[intel/2017a] DFTB+ v1.3.1 #4398
{phys}[intel/2017a] DFTB+ v1.3.1 #4398
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requires #4336 |
requires manual download after (free) registration |
Travis test report: 8/8 runs failed - see https://travis-ci.org/hpcugent/easybuild-easyconfigs/builds/215469761 Only showing partial log for 1st failed test suite run 4112.1;
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prebuildopts = "sed 's/ARCH = x86_64-linux-intel/ARCH = user/' Makefile.user.template > Makefile.user && " | ||
prebuildopts += "cp sysmakes/make.x86_64-linux-intel sysmakes/make.user && " | ||
prebuildopts += "sed -i 's|LNOPT = -static|#LNOPT = -static|' sysmakes/make.user && " | ||
prebuildopts += "sed -i 's|/opt/intel/mkl/10.2.6.038/lib/em64t|$(MKLROOT)|' sysmakes/make.user && " |
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@migueldiascosta are these sed
commands really needed? Can't you just override these values with arguments to make
via buildopts
?
buildopts = 'ARCH=user LNOPT= '
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you're right, simplifying
Travis test report: 8/8 runs failed - see https://travis-ci.org/hpcugent/easybuild-easyconfigs/builds/215583733 Only showing partial log for 1st failed test suite run 4118.1;
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Test report by @migueldiascosta |
Test report by @migueldiascosta |
('arpack-ng', '3.4.0'), | ||
] | ||
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subdir = '%dftbplus-%(version)s' |
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@migueldiascosta This is unused, so please remove?
subdir = '%dftbplus-%(version)s' | ||
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prebuildopts = "cp sysmakes/make.x86_64-linux-intel sysmakes/make.user && " | ||
prebuildopts += "cd prg_dftb && " |
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collapse to a single line?
Travis test report: 8/8 runs failed - see https://travis-ci.org/hpcugent/easybuild-easyconfigs/builds/215841133 Only showing partial log for 1st failed test suite run 4126.1;
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Test report by @boegel |
lgtm |
Test report by @boegel |
Going in, thanks @migueldiascosta! |
(created using
eb --new-pr
)