pair_pace.cpp: check that units are "metal"
update ace-evaluator (download link + md5sum in cmake and make build systems): accept multilines comment at the beginning of potential.ace file add first comment line for potentials/Cu-PBE-core-rep.ace
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@ -12,20 +12,22 @@ from argparse import ArgumentParser
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sys.path.append('..')
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from install_helpers import fullpath, geturl, checkmd5sum
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parser = ArgumentParser(prog='Install.py',
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description="LAMMPS library build wrapper script")
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# settings
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thisdir = fullpath('.')
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version = "v.2021.2.3.upd2"
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version = 'v.2021.4.9'
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# known checksums for different PACE versions. used to validate the download.
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checksums = { \
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'v.2021.2.3.upd2' : '8fd1162724d349b930e474927197f20d', \
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'v.2021.2.3.upd2' : '8fd1162724d349b930e474927197f20d',
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'v.2021.4.9' : '4db54962fbd6adcf8c18d46e1798ceb5',
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}
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parser = ArgumentParser(prog='Install.py',
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description="LAMMPS library build wrapper script")
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# help message
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HELP = """
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