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https://git.FreeBSD.org/ports.git
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science/lammps: Update patch_15Jun2023 → stable_2Aug2023
Also: * add tests * correct PORTVERSION: add leading zero to the day
This commit is contained in:
Yuri Victorovich
parent
afb34f1d3b
commit
482101080e
@ -1,6 +1,5 @@
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PORTNAME= lammps
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PORTVERSION= ${GH_TAGNAME:C/(stable|patch)_([0-9]{1,2})([A-Z][a-z][a-z])([0-9]{4})/\4.\3.\2/S/Jan/01/S/Feb/02/S/Mar/03/S/Apr/04/S/May/05/S/Jun/06/S/Jul/07/S/Aug/08/S/Sep/09/S/Oct/10/S/Nov/11/S/Dec/12/S/_update/./}
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PORTREVISION= 1
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PORTVERSION= ${GH_TAGNAME:C/(stable|patch)_([0-9]{1,2})([A-Z][a-z][a-z])([0-9]{4})/\4.\3.\2/S/Jan/01/S/Feb/02/S/Mar/03/S/Apr/04/S/May/05/S/Jun/06/S/Jul/07/S/Aug/08/S/Sep/09/S/Oct/10/S/Nov/11/S/Dec/12/S/_update/./:C/\.([1-9])$/.0\1/}
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CATEGORIES= science
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MAINTAINER= yuri@FreeBSD.org
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@ -20,13 +19,13 @@ LIB_DEPENDS= libevent.so:devel/libevent \
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libssh2.so:security/libssh2 \
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libzstd.so:archivers/zstd
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USES= blaslapack:openblas cmake:noninja compiler:c++14-lang eigen:3 fortran gnome localbase:ldflags python shebangfix
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USES= blaslapack:openblas cmake:noninja,testing compiler:c++14-lang eigen:3 fortran gnome localbase:ldflags python shebangfix
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USE_GNOME= libxml2
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USE_LDCONFIG= yes
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USE_PYTHON= cython
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USE_GITHUB= yes
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GH_TAGNAME= patch_15Jun2023
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GH_TAGNAME= stable_2Aug2023
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SHEBANG_GLOB= *.sh *.bash
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SHEBANG_FILES= lib/kokkos/bin/nvcc_wrapper
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@ -36,6 +35,7 @@ CMAKE_SOURCE_PATH= ${WRKSRC}/cmake
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CMAKE_ARGS= -DBLA_VENDOR:STRING="OpenBLAS" ${CMAKE_ARGS_${CHOSEN_COMPILER_TYPE}} \
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-DPython_EXECUTABLE=${PYTHON_CMD}
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CMAKE_ARGS_gcc= -DBUILD_OMP:BOOL=false
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CMAKE_TESTING_ON= ENABLE_TESTING # 3 tests fail, see https://github.com/lammps/lammps/issues/3875
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# enable packages (for a complete list see STANDARD_PACKAGES in cmake/CMakeLists.txt)
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CMAKE_ON+= PKG_ASPHERE PKG_ATC PKG_AWPMD PKG_BOCS PKG_BODY PKG_BROWNIAN PKG_CG-DNA PKG_CG-SDK PKG_CLASS2
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@ -1,3 +1,3 @@
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TIMESTAMP = 1689544945
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SHA256 (lammps-lammps-2023.06.15-patch_15Jun2023_GH0.tar.gz) = 8470ed7b26ccd3728f4b44a7f1c520f1af23a648af685fd30b42b840fdfae2ff
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SIZE (lammps-lammps-2023.06.15-patch_15Jun2023_GH0.tar.gz) = 128943206
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TIMESTAMP = 1691086516
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SHA256 (lammps-lammps-2023.08.02-stable_2Aug2023_GH0.tar.gz) = 48dc8b0b0583689e80ea2052275acbc3e3fce89707ac557e120db5564257f7df
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SIZE (lammps-lammps-2023.08.02-stable_2Aug2023_GH0.tar.gz) = 131412313
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@ -48,6 +48,118 @@ lib/cmake/LAMMPS/LAMMPS_Targets.cmake
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lib/liblammps.so
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lib/liblammps.so.0
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libdata/pkgconfig/liblammps.pc
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%%DATADIR%%/bench/Cu_u3.eam
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%%DATADIR%%/bench/POTENTIALS/CH.airebo
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%%DATADIR%%/bench/POTENTIALS/CH.rebo
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%%DATADIR%%/bench/POTENTIALS/CdTe.bop.table
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%%DATADIR%%/bench/POTENTIALS/Cu_u3.eam
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%%DATADIR%%/bench/POTENTIALS/Ni.adp
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%%DATADIR%%/bench/POTENTIALS/Ni.meam
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%%DATADIR%%/bench/POTENTIALS/README
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%%DATADIR%%/bench/POTENTIALS/Si.sw
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%%DATADIR%%/bench/POTENTIALS/Si.tersoff
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%%DATADIR%%/bench/POTENTIALS/data.airebo
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%%DATADIR%%/bench/POTENTIALS/data.comb
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%%DATADIR%%/bench/POTENTIALS/data.eff
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%%DATADIR%%/bench/POTENTIALS/data.eim
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%%DATADIR%%/bench/POTENTIALS/data.fene
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%%DATADIR%%/bench/POTENTIALS/data.gb
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%%DATADIR%%/bench/POTENTIALS/data.granular
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%%DATADIR%%/bench/POTENTIALS/data.protein
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%%DATADIR%%/bench/POTENTIALS/data.reax
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%%DATADIR%%/bench/POTENTIALS/data.rebo
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%%DATADIR%%/bench/POTENTIALS/data.spce
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%%DATADIR%%/bench/POTENTIALS/ffield.comb
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%%DATADIR%%/bench/POTENTIALS/ffield.eim
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%%DATADIR%%/bench/POTENTIALS/ffield.reax
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%%DATADIR%%/bench/POTENTIALS/in.adp
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%%DATADIR%%/bench/POTENTIALS/in.airebo
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%%DATADIR%%/bench/POTENTIALS/in.bop
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%%DATADIR%%/bench/POTENTIALS/in.comb
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%%DATADIR%%/bench/POTENTIALS/in.dpd
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%%DATADIR%%/bench/POTENTIALS/in.eam
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%%DATADIR%%/bench/POTENTIALS/in.eff
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%%DATADIR%%/bench/POTENTIALS/in.eim
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%%DATADIR%%/bench/POTENTIALS/in.fene
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%%DATADIR%%/bench/POTENTIALS/in.gb
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%%DATADIR%%/bench/POTENTIALS/in.granular
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%%DATADIR%%/bench/POTENTIALS/in.lj
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%%DATADIR%%/bench/POTENTIALS/in.meam
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%%DATADIR%%/bench/POTENTIALS/in.peri
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%%DATADIR%%/bench/POTENTIALS/in.protein
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%%DATADIR%%/bench/POTENTIALS/in.reaxc
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%%DATADIR%%/bench/POTENTIALS/in.rebo
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%%DATADIR%%/bench/POTENTIALS/in.spce
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%%DATADIR%%/bench/POTENTIALS/in.sw
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%%DATADIR%%/bench/POTENTIALS/in.tersoff
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%%DATADIR%%/bench/POTENTIALS/library.meam
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.adp.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.adp.4
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.airebo.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.airebo.4
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.bop.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.bop.4
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.comb.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.comb.4
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.dpd.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.dpd.4
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.eam.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.eam.4
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.eff.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.eff.4
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.eim.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.eim.4
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.fene.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.fene.4
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.gb.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.gb.4
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.granular.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.granular.4
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.lj.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.lj.4
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.meam.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.meam.4
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.peri.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.peri.4
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.protein.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.protein.4
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.reaxc.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.reaxc.4
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.rebo.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.rebo.4
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.spce.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.spce.4
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.sw.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.sw.4
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.tersoff.1
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%%DATADIR%%/bench/POTENTIALS/log.9Oct20.tersoff.4
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%%DATADIR%%/bench/README
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%%DATADIR%%/bench/data.chain
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%%DATADIR%%/bench/data.chute
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%%DATADIR%%/bench/data.rhodo
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%%DATADIR%%/bench/in.chain
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%%DATADIR%%/bench/in.chain.scaled
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%%DATADIR%%/bench/in.chute
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%%DATADIR%%/bench/in.chute.scaled
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%%DATADIR%%/bench/in.eam
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%%DATADIR%%/bench/in.lj
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%%DATADIR%%/bench/in.rhodo
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%%DATADIR%%/bench/in.rhodo.scaled
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%%DATADIR%%/bench/log.6Oct16.chain.fixed.icc.1
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%%DATADIR%%/bench/log.6Oct16.chain.fixed.icc.4
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%%DATADIR%%/bench/log.6Oct16.chain.scaled.icc.4
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%%DATADIR%%/bench/log.6Oct16.chute.fixed.icc.1
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%%DATADIR%%/bench/log.6Oct16.chute.fixed.icc.4
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%%DATADIR%%/bench/log.6Oct16.chute.scaled.icc.4
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%%DATADIR%%/bench/log.6Oct16.eam.fixed.icc.1
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%%DATADIR%%/bench/log.6Oct16.eam.fixed.icc.4
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%%DATADIR%%/bench/log.6Oct16.eam.scaled.icc.4
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%%DATADIR%%/bench/log.6Oct16.lj.fixed.icc.1
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%%DATADIR%%/bench/log.6Oct16.lj.fixed.icc.4
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%%DATADIR%%/bench/log.6Oct16.lj.scaled.icc.4
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%%DATADIR%%/bench/log.6Oct16.rhodo.fixed.icc.1
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%%DATADIR%%/bench/log.6Oct16.rhodo.fixed.icc.4
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%%DATADIR%%/bench/log.6Oct16.rhodo.scaled.icc.4
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%%DATADIR%%/potentials/Ag_u3.eam
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%%DATADIR%%/potentials/AlCu.adp
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%%DATADIR%%/potentials/AlCu.bop.table
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