30 lines
758 B
Lua
30 lines
758 B
Lua
whatis([==[My compiled version of GPAW]==])
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conflict("GPAW")
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function ld (m)
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if not ( isloaded(m) ) then
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load(m)
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end
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end
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ld("clusterappl")
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local nobackup = os.getenv("MYNOBACKUP")
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local root = pathJoin(nobackup, "git/gpaw/20.1.0")
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ld("iccifort/2019.5.281")
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ld("impi/2018.5.288")
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ld("imkl/2019.5.281")
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ld("Python/3.7.4")
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ld("SciPy-bundle/2019.10-Python-3.7.4")
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ld("ASE/3.19.0-Python-3.7.4")
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ld("libxc/4.3.4")
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ld("gpaw-setups/0.9.20000")
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setenv("OMP_NUM_THREADS", 1)
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prepend_path("PATH", pathJoin(root, "tools"))
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prepend_path("PYTHONPATH", root)
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prepend_path("PYTHONPATH", pathJoin(root, "build/lib.linux-x86_64-3.7"))
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execute {cmd='complete -o default -C "/usr/bin/python3 ' .. root .. '/gpaw/cli/complete.py" gpaw', modeA={"load"}}
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