svn commit: r478654 - in head/science: . jdftx jdftx/files
Yuri Victorovich
yuri at FreeBSD.org
Sat Sep 1 06:30:49 UTC 2018
Author: yuri
Date: Sat Sep 1 06:30:47 2018
New Revision: 478654
URL: https://svnweb.freebsd.org/changeset/ports/478654
Log:
New port: science/jdftx: Software for joint density functional theory in chemistry
Added:
head/science/jdftx/
head/science/jdftx/Makefile (contents, props changed)
head/science/jdftx/distinfo (contents, props changed)
head/science/jdftx/files/
head/science/jdftx/files/patch-CMakeLists.txt (contents, props changed)
head/science/jdftx/files/patch-core_scalar.h (contents, props changed)
head/science/jdftx/pkg-descr (contents, props changed)
head/science/jdftx/pkg-plist (contents, props changed)
Modified:
head/science/Makefile
Modified: head/science/Makefile
==============================================================================
--- head/science/Makefile Sat Sep 1 03:34:24 2018 (r478653)
+++ head/science/Makefile Sat Sep 1 06:30:47 2018 (r478654)
@@ -88,6 +88,7 @@
SUBDIR += hypre
SUBDIR += iboview
SUBDIR += isaac-cfd
+ SUBDIR += jdftx
SUBDIR += jstrack
SUBDIR += kalzium
SUBDIR += kalzium-kde4
Added: head/science/jdftx/Makefile
==============================================================================
--- /dev/null 00:00:00 1970 (empty, because file is newly added)
+++ head/science/jdftx/Makefile Sat Sep 1 06:30:47 2018 (r478654)
@@ -0,0 +1,62 @@
+# $FreeBSD$
+
+PORTNAME= jdftx
+DISTVERSIONPREFIX= v
+DISTVERSION= 1.4.2-73
+DISTVERSIONSUFFIX= -g73b17437
+CATEGORIES= science
+
+MAINTAINER= yuri at FreeBSD.org
+COMMENT= Software for joint density functional theory in chemistry
+
+LICENSE= GPLv3+
+LICENSE_FILE= ${WRKSRC}/COPYING
+
+LIB_DEPENDS= libblas.so:math/blas \
+ libcblas.so:math/cblas \
+ libfftw3.so:math/fftw3 \
+ libgsl.so:math/gsl \
+ liblapack.so:math/lapack
+TEST_DEPENDS= bash:shells/bash
+
+USES= cmake:outsource fortran localbase:ldflags shebangfix
+SHEBANG_GLOB= *.sh
+USE_GITHUB= yes
+GH_ACCOUNT= shankar1729
+USE_LDCONFIG= yes
+
+TEST_TARGET= test
+
+WRKSRC_SUBDIR= ${PORTNAME}
+
+CMAKE_ARGS= -DLAPACK_LIBRARIES:STRING="-llapack -lblas"
+
+OPTIONS_DEFINE= MPI LIBXC HDF5 SCALAPACK
+OPTIONS_DEFAULT= MPI LIBXC
+
+MPI_CMAKE_BOOL= EnableMPI
+MPI_LIB_DEPENDS= libmpich.so:net/mpich2
+
+LIBXC_DESC= Use LibXC for additional exchange-correlation functionals
+LIBXC_CMAKE_BOOL= EnableLibXC
+LIBXC_LIB_DEPENDS= libxc.so:science/libxc
+
+HDF5_CMAKE_BOOL= EnableHDF5
+HDF5_LIB_DEPENDS= libhdf5.so:science/hdf5
+HDF5_BROKEN= use of undeclared identifier 'H5Pset_dxpl_mpio' # https://github.com/shankar1729/jdftx/issues/37
+
+SCALAPACK_DESC= Enable ScaLAPACK support
+SCALAPACK_CMAKE_BOOL= EnableScaLAPACK
+SCALAPACK_LIB_DEPENDS= libscalapack.so:math/scalapack
+
+do-install:
+ ${INSTALL_PROGRAM} ${BUILD_WRKSRC}/${PORTNAME} ${STAGEDIR}${PREFIX}/bin
+ ${INSTALL_PROGRAM} ${BUILD_WRKSRC}/phonon ${STAGEDIR}${PREFIX}/bin
+ ${INSTALL_PROGRAM} ${BUILD_WRKSRC}/wannier ${STAGEDIR}${PREFIX}/bin
+ ${INSTALL_PROGRAM} ${BUILD_WRKSRC}/libjdftx.so ${STAGEDIR}${PREFIX}/lib
+ @${MKDIR} ${STAGEDIR}${DATADIR}/pseudopotentials
+.for pp in GBRV-2017 GBRV SG15-pulay SG15
+ cd ${STAGEDIR}${DATADIR}/pseudopotentials && ${TAR} xzf ${WRKSRC}/pseudopotentials/${pp}.tgz
+.endfor
+
+.include <bsd.port.mk>
Added: head/science/jdftx/distinfo
==============================================================================
--- /dev/null 00:00:00 1970 (empty, because file is newly added)
+++ head/science/jdftx/distinfo Sat Sep 1 06:30:47 2018 (r478654)
@@ -0,0 +1,3 @@
+TIMESTAMP = 1535759151
+SHA256 (shankar1729-jdftx-v1.4.2-73-g73b17437_GH0.tar.gz) = 77651051c09796ded793fb781022d9b3aca43a31f9bcfb999c646e4ef13017c9
+SIZE (shankar1729-jdftx-v1.4.2-73-g73b17437_GH0.tar.gz) = 56831467
Added: head/science/jdftx/files/patch-CMakeLists.txt
==============================================================================
--- /dev/null 00:00:00 1970 (empty, because file is newly added)
+++ head/science/jdftx/files/patch-CMakeLists.txt Sat Sep 1 06:30:47 2018 (r478654)
@@ -0,0 +1,37 @@
+--- CMakeLists.txt.orig 2018-08-24 15:03:02 UTC
++++ CMakeLists.txt
+@@ -97,7 +97,7 @@ if(EnableMPI)
+ add_definitions("-DMPI_ENABLED")
+ endif()
+
+-option(EnableLibXC "Use LibXC to provide additional exchange-correlation functionals")
++option(EnableLibXC "Use LibXC to provide additional exchange-correlation functionals" OFF)
+ if(EnableLibXC)
+ find_package(LIBXC REQUIRED)
+ include_directories(${LIBXC_INCLUDE_DIR})
+@@ -223,7 +223,7 @@ endif()
+ #Library with all the functionality:
+ FILE(GLOB jdftxlibSources core/*.cpp fluid/*.cpp electronic/*.cpp commands/*.cpp)
+ add_library(jdftxlib ${LINK_TYPE} ${jdftxlibSources})
+-target_link_libraries(jdftxlib ${EXTERNAL_LIBS})
++target_link_libraries(jdftxlib ${EXTERNAL_LIBS} -lexecinfo) # execinfo only for libxc?
+ set_target_properties(jdftxlib PROPERTIES OUTPUT_NAME "jdftx")
+ set_JDFTx_flags(jdftxlib OFF)
+
+@@ -232,6 +232,16 @@ set_JDFTx_flags(jdftxlib OFF)
+ option(EnableCUDA "Enable NVIDIA GPU support using CUDA" OFF)
+ option(EnableCuSolver "Whether to use cuSolver GPU LAPACK (Requires CUDA >= 9)" OFF)
+
++include(CheckFunctionExists)
++CHECK_FUNCTION_EXISTS(sincos HAVE_SINCOS_FUNCTION)
++
++if(NOT HAVE_SINCOS_FUNCTION)
++ MESSAGE("Do not have function sincos")
++ add_definitions("-DMISSING_SINCOS_FUNCTION")
++else()
++ MESSAGE("Found function sincos")
++endif()
++
+ if(EnableCUDA)
+ find_package(CUDA REQUIRED)
+ set(CUDA_ARCH "compute_35" CACHE STRING "CUDA virtual architecture to compile for")
Added: head/science/jdftx/files/patch-core_scalar.h
==============================================================================
--- /dev/null 00:00:00 1970 (empty, because file is newly added)
+++ head/science/jdftx/files/patch-core_scalar.h Sat Sep 1 06:30:47 2018 (r478654)
@@ -0,0 +1,11 @@
+--- core/scalar.h.orig 2018-08-24 15:03:02 UTC
++++ core/scalar.h
+@@ -54,7 +54,7 @@ template<class T> T ceildiv(T num, T den
+ //! Return largest multiple of den smaller than num, templated over int types
+ template<class T> T floorMultiple(T num, T den) { return (num/den)*den; }
+
+-#ifdef __APPLE__
++#ifdef MISSING_SINCOS_FUNCTION
+ #ifndef __in_a_cu_file__
+ inline void sincos(double x, double* s, double* c)
+ { *s = sin(x);
Added: head/science/jdftx/pkg-descr
==============================================================================
--- /dev/null 00:00:00 1970 (empty, because file is newly added)
+++ head/science/jdftx/pkg-descr Sat Sep 1 06:30:47 2018 (r478654)
@@ -0,0 +1,14 @@
+JDFTx is a software package for quantum chemistry computations.
+
+JDFTx supports all the standard functionality present in any electronic DFT
+software. It supports several semilocal, meta-GGA and EXX-hybrid
+exchange-correlation functions, with additional options available by linking to
+LibXC [18]. DFT+U [5] is available for treating localized electrons. Pair
+potential dispersion corrections [10] are available for including van der Waals
+interactions. JDFTx supports several formats of norm-conserving and ultrasoft
+pseudopotentials and comes pre-installed with an opens-ource library for each.
+With truncated Coulomb interactions [27], JDFTx enables accurate calculations
+of systems of any dimensionality from 0 to 3: molecules, wires, slabs/2D
+materials and bulk.
+
+WWW: http://jdftx.org/
Added: head/science/jdftx/pkg-plist
==============================================================================
--- /dev/null 00:00:00 1970 (empty, because file is newly added)
+++ head/science/jdftx/pkg-plist Sat Sep 1 06:30:47 2018 (r478654)
@@ -0,0 +1,426 @@
+bin/jdftx
+bin/phonon
+bin/wannier
+lib/libjdftx.so
+%%DATADIR%%/pseudopotentials/GBRV/COPYING
+%%DATADIR%%/pseudopotentials/GBRV/README
+%%DATADIR%%/pseudopotentials/GBRV/ag_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ag_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ag_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ag_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ag_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/al_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/al_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/al_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/as_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/as_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/as_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/au_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/au_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/au_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/b_lda_v1.01.uspp
+%%DATADIR%%/pseudopotentials/GBRV/b_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/b_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/b_pbe_v1.01.uspp
+%%DATADIR%%/pseudopotentials/GBRV/b_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/b_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ba_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ba_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ba_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/be_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/be_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/be_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/be_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/be_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/bi_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/bi_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/bi_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/br_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/br_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/br_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/br_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/br_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/c_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/c_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/c_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/c_pbesol_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ca_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ca_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ca_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/cd_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/cd_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/cd_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/cl_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/cl_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/cl_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/cl_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/cl_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/co_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/co_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/co_pbesol_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/cr_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/cr_lda_v1.5.uspp
+%%DATADIR%%/pseudopotentials/GBRV/cr_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/cr_pbe_v1.5.uspp
+%%DATADIR%%/pseudopotentials/GBRV/cr_pbesol_v1.5.uspp
+%%DATADIR%%/pseudopotentials/GBRV/cs_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/cs_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/cs_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/cu_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/cu_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/cu_pbesol_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/f_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/f_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/f_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/f_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/f_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/fe_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/fe_lda_v1.5.uspp
+%%DATADIR%%/pseudopotentials/GBRV/fe_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/fe_pbe_v1.5.uspp
+%%DATADIR%%/pseudopotentials/GBRV/fe_pbesol_v1.5.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ga_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ga_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ga_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ga_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ga_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ge_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ge_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ge_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ge_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ge_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/h_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/h_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/h_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/h_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/h_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/hf_lda_plus4_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/hf_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/hf_pbe_plus4_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/hf_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/hf_pbesol_plus4_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/hf_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/hg_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/hg_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/hg_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/i_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/i_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/i_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/in_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/in_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/in_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/in_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/in_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ir_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ir_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ir_pbesol_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/k_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/k_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/k_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/k_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/k_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/la_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/la_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/la_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/li_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/li_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/li_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/li_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/li_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/mg_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/mg_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/mg_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/mg_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/mg_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/mn_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/mn_lda_v1.5.uspp
+%%DATADIR%%/pseudopotentials/GBRV/mn_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/mn_pbe_v1.5.uspp
+%%DATADIR%%/pseudopotentials/GBRV/mn_pbesol_v1.5.uspp
+%%DATADIR%%/pseudopotentials/GBRV/mo_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/mo_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/mo_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/n_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/n_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/n_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/n_pbesol_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/na_lda_v1.5.uspp
+%%DATADIR%%/pseudopotentials/GBRV/na_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/na_pbe_v1.5.uspp
+%%DATADIR%%/pseudopotentials/GBRV/na_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/na_pbesol_v1.5.uspp
+%%DATADIR%%/pseudopotentials/GBRV/nb_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/nb_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/nb_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ni_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ni_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ni_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ni_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ni_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/o_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/o_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/o_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/o_pbesol_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/os_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/os_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/os_pbesol_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/p_lda_v1.5.uspp
+%%DATADIR%%/pseudopotentials/GBRV/p_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/p_pbe_v1.5.uspp
+%%DATADIR%%/pseudopotentials/GBRV/p_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/p_pbesol_v1.5.uspp
+%%DATADIR%%/pseudopotentials/GBRV/pb_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/pb_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/pb_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/pd_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/pd_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/pd_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/pd_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/pd_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/pt_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/pt_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/pt_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/pt_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/pt_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/rb_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/rb_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/rb_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/re_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/re_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/re_pbesol_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/rh_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/rh_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/rh_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/rh_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/rh_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ru_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ru_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ru_pbesol_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/s_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/s_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/s_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/s_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/s_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/sb_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/sb_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/sb_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/sb_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/sb_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/sc_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/sc_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/sc_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/se_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/se_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/se_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/si_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/si_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/si_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/sn_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/sn_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/sn_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/sn_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/sn_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/sr_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/sr_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/sr_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ta_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ta_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ta_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/tc_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/tc_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/tc_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/te_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/te_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/te_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ti_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ti_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ti_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ti_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/ti_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/tl_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/tl_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/tl_pbesol_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/v_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/v_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/v_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/v_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/v_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/w_lda_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/w_pbe_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/w_pbesol_v1.2.uspp
+%%DATADIR%%/pseudopotentials/GBRV/y_lda_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/y_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/y_pbe_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/y_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/y_pbesol_v1.4.uspp
+%%DATADIR%%/pseudopotentials/GBRV/zn_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/zn_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/zn_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/zr_lda_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/zr_pbe_v1.uspp
+%%DATADIR%%/pseudopotentials/GBRV/zr_pbesol_v1.uspp
+%%DATADIR%%/pseudopotentials/SG15/Ag_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Ag_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Al_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Al_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Ar_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Ar_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Ar_ONCV_PBE-1.1.pulay
+%%DATADIR%%/pseudopotentials/SG15/Ar_ONCV_PBE-1.1.upf
+%%DATADIR%%/pseudopotentials/SG15/As_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/As_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/As_ONCV_PBE-1.1.pulay
+%%DATADIR%%/pseudopotentials/SG15/As_ONCV_PBE-1.1.upf
+%%DATADIR%%/pseudopotentials/SG15/Au_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Au_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/B_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/B_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Ba_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Ba_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Be_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Be_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Bi_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Bi_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Br_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Br_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/C_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/C_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Ca_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Ca_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Cd_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Cd_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Cl_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Cl_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Cl_ONCV_PBE-1.1.pulay
+%%DATADIR%%/pseudopotentials/SG15/Cl_ONCV_PBE-1.1.upf
+%%DATADIR%%/pseudopotentials/SG15/Co_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Co_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Cr_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Cr_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Cs_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Cs_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Cs_ONCV_PBE-1.1.pulay
+%%DATADIR%%/pseudopotentials/SG15/Cs_ONCV_PBE-1.1.upf
+%%DATADIR%%/pseudopotentials/SG15/Cu_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Cu_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/F_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/F_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Fe_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Fe_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Ga_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Ga_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Ge_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Ge_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/H_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/H_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/He_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/He_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Hf_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Hf_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Hg_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/I_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/I_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/I_ONCV_PBE-1.1.pulay
+%%DATADIR%%/pseudopotentials/SG15/I_ONCV_PBE-1.1.upf
+%%DATADIR%%/pseudopotentials/SG15/In_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/In_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/In_ONCV_PBE-1.1.pulay
+%%DATADIR%%/pseudopotentials/SG15/In_ONCV_PBE-1.1.upf
+%%DATADIR%%/pseudopotentials/SG15/Ir_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Ir_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/K_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/K_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Kr_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Kr_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/La_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/La_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Li_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Li_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Mg_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Mg_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Mn_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Mn_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Mo_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Mo_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/N_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/N_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Na_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Na_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Nb_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Nb_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Ne_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Ni_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Ni_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/O_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/O_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Os_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Os_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/P_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/P_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/P_ONCV_PBE-1.1.pulay
+%%DATADIR%%/pseudopotentials/SG15/P_ONCV_PBE-1.1.upf
+%%DATADIR%%/pseudopotentials/SG15/Pb_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Pb_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Pd_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Pd_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Pt_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Pt_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/README
+%%DATADIR%%/pseudopotentials/SG15/Rb_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Rb_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Re_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Re_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Rh_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Rh_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Ru_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Ru_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/S_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/S_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/S_ONCV_PBE-1.1.pulay
+%%DATADIR%%/pseudopotentials/SG15/S_ONCV_PBE-1.1.upf
+%%DATADIR%%/pseudopotentials/SG15/Sb_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Sb_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Sb_ONCV_PBE-1.1.pulay
+%%DATADIR%%/pseudopotentials/SG15/Sb_ONCV_PBE-1.1.upf
+%%DATADIR%%/pseudopotentials/SG15/Sc_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Sc_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Se_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Se_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Se_ONCV_PBE-1.1.pulay
+%%DATADIR%%/pseudopotentials/SG15/Se_ONCV_PBE-1.1.upf
+%%DATADIR%%/pseudopotentials/SG15/Si_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Si_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Si_ONCV_PBE-1.1.pulay
+%%DATADIR%%/pseudopotentials/SG15/Si_ONCV_PBE-1.1.upf
+%%DATADIR%%/pseudopotentials/SG15/Sn_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Sn_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Sn_ONCV_PBE-1.1.pulay
+%%DATADIR%%/pseudopotentials/SG15/Sn_ONCV_PBE-1.1.upf
+%%DATADIR%%/pseudopotentials/SG15/Sr_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Sr_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Ta_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Ta_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Tc_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Tc_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Te_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Te_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Te_ONCV_PBE-1.1.pulay
+%%DATADIR%%/pseudopotentials/SG15/Te_ONCV_PBE-1.1.upf
+%%DATADIR%%/pseudopotentials/SG15/Ti_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Ti_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Tl_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Tl_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/V_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/V_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/W_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/W_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Xe_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Xe_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Xe_ONCV_PBE-1.1.pulay
+%%DATADIR%%/pseudopotentials/SG15/Xe_ONCV_PBE-1.1.upf
+%%DATADIR%%/pseudopotentials/SG15/Y_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Y_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Zn_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Zn_ONCV_PBE-1.0.upf
+%%DATADIR%%/pseudopotentials/SG15/Zr_ONCV_PBE-1.0.pulay
+%%DATADIR%%/pseudopotentials/SG15/Zr_ONCV_PBE-1.0.upf
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