From owner-svn-ports-all@freebsd.org Sat Sep 1 19:10:48 2018 Return-Path: Delivered-To: svn-ports-all@mailman.ysv.freebsd.org Received: from mx1.freebsd.org (mx1.freebsd.org [IPv6:2610:1c1:1:606c::19:1]) by mailman.ysv.freebsd.org (Postfix) with ESMTP id BCA25FF7BC4; Sat, 1 Sep 2018 19:10:47 +0000 (UTC) (envelope-from yuri@FreeBSD.org) Received: from mxrelay.nyi.freebsd.org (mxrelay.nyi.freebsd.org [IPv6:2610:1c1:1:606c::19:3]) (using TLSv1.2 with cipher ECDHE-RSA-AES256-GCM-SHA384 (256/256 bits)) (Client CN "mxrelay.nyi.freebsd.org", Issuer "Let's Encrypt Authority X3" (verified OK)) by mx1.freebsd.org (Postfix) with ESMTPS id 77F7D7763B; Sat, 1 Sep 2018 19:10:47 +0000 (UTC) (envelope-from yuri@FreeBSD.org) Received: from repo.freebsd.org (repo.freebsd.org [IPv6:2610:1c1:1:6068::e6a:0]) (using TLSv1.2 with cipher ECDHE-RSA-AES256-GCM-SHA384 (256/256 bits)) (Client did not present a certificate) by mxrelay.nyi.freebsd.org (Postfix) with ESMTPS id 728CC68E3; Sat, 1 Sep 2018 19:10:47 +0000 (UTC) (envelope-from yuri@FreeBSD.org) Received: from repo.freebsd.org ([127.0.1.37]) by repo.freebsd.org (8.15.2/8.15.2) with ESMTP id w81JAlvH024630; Sat, 1 Sep 2018 19:10:47 GMT (envelope-from yuri@FreeBSD.org) Received: (from yuri@localhost) by repo.freebsd.org (8.15.2/8.15.2/Submit) id w81JAlHO024627; Sat, 1 Sep 2018 19:10:47 GMT (envelope-from yuri@FreeBSD.org) Message-Id: <201809011910.w81JAlHO024627@repo.freebsd.org> X-Authentication-Warning: repo.freebsd.org: yuri set sender to yuri@FreeBSD.org using -f From: Yuri Victorovich Date: Sat, 1 Sep 2018 19:10:47 +0000 (UTC) To: ports-committers@freebsd.org, svn-ports-all@freebsd.org, svn-ports-head@freebsd.org Subject: svn commit: r478716 - head/science/jdftx X-SVN-Group: ports-head X-SVN-Commit-Author: yuri X-SVN-Commit-Paths: head/science/jdftx X-SVN-Commit-Revision: 478716 X-SVN-Commit-Repository: ports MIME-Version: 1.0 Content-Type: text/plain; charset=UTF-8 Content-Transfer-Encoding: 8bit X-BeenThere: svn-ports-all@freebsd.org X-Mailman-Version: 2.1.27 Precedence: list List-Id: SVN commit messages for the ports tree List-Unsubscribe: , List-Archive: List-Post: List-Help: List-Subscribe: , X-List-Received-Date: Sat, 01 Sep 2018 19:10:48 -0000 Author: yuri Date: Sat Sep 1 19:10:46 2018 New Revision: 478716 URL: https://svnweb.freebsd.org/changeset/ports/478716 Log: science/jdftxL Update 1.4.2-73 -> 1.4.2-74 * The upstream implemented the 'install' target * Add OCTAVE option for one script Modified: head/science/jdftx/Makefile head/science/jdftx/distinfo head/science/jdftx/pkg-plist Modified: head/science/jdftx/Makefile ============================================================================== --- head/science/jdftx/Makefile Sat Sep 1 19:02:13 2018 (r478715) +++ head/science/jdftx/Makefile Sat Sep 1 19:10:46 2018 (r478716) @@ -2,8 +2,8 @@ PORTNAME= jdftx DISTVERSIONPREFIX= v -DISTVERSION= 1.4.2-73 -DISTVERSIONSUFFIX= -g73b17437 +DISTVERSION= 1.4.2-74 +DISTVERSIONSUFFIX= -gba743849 CATEGORIES= science MAINTAINER= yuri@FreeBSD.org @@ -17,10 +17,13 @@ LIB_DEPENDS= libblas.so:math/blas \ libfftw3.so:math/fftw3 \ libgsl.so:math/gsl \ liblapack.so:math/lapack +RUN_DEPENDS= bash:shells/bash TEST_DEPENDS= bash:shells/bash USES= cmake:outsource fortran localbase:ldflags shebangfix SHEBANG_GLOB= *.sh +SHEBANG_FILES= scripts/* +SHEBANG_LANG= octave USE_GITHUB= yes GH_ACCOUNT= shankar1729 USE_LDCONFIG= yes @@ -31,7 +34,7 @@ WRKSRC_SUBDIR= ${PORTNAME} CMAKE_ARGS= -DLAPACK_LIBRARIES:STRING="-llapack -lblas" -OPTIONS_DEFINE= MPI LIBXC HDF5 SCALAPACK +OPTIONS_DEFINE= MPI LIBXC HDF5 SCALAPACK OCTAVE OPTIONS_DEFAULT= MPI LIBXC MPI_CMAKE_BOOL= EnableMPI @@ -49,14 +52,7 @@ 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 +OCTAVE_DESC= With Octave support (only for one script: dryRunToPDB) +OCTAVE_USES= octave .include Modified: head/science/jdftx/distinfo ============================================================================== --- head/science/jdftx/distinfo Sat Sep 1 19:02:13 2018 (r478715) +++ head/science/jdftx/distinfo Sat Sep 1 19:10:46 2018 (r478716) @@ -1,3 +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 +TIMESTAMP = 1535827376 +SHA256 (shankar1729-jdftx-v1.4.2-74-gba743849_GH0.tar.gz) = 8ed7beca0775dd71630913ac17ad2407787a3acba3c3c2266f6d3453387fa647 +SIZE (shankar1729-jdftx-v1.4.2-74-gba743849_GH0.tar.gz) = 56831516 Modified: head/science/jdftx/pkg-plist ============================================================================== --- head/science/jdftx/pkg-plist Sat Sep 1 19:02:13 2018 (r478715) +++ head/science/jdftx/pkg-plist Sat Sep 1 19:10:46 2018 (r478716) @@ -1,426 +1,901 @@ bin/jdftx bin/phonon bin/wannier +include/jdftx/commands/ParamList.h +include/jdftx/commands/command.h +include/jdftx/commands/minimize.h +include/jdftx/commands/parser.h +include/jdftx/config.h +include/jdftx/core/BlasExtra.h +include/jdftx/core/BlasExtra_internal.h +include/jdftx/core/Blip.h +include/jdftx/core/Coulomb.h +include/jdftx/core/CoulombIsolated.h +include/jdftx/core/CoulombKernel.h +include/jdftx/core/CoulombPeriodic.h +include/jdftx/core/CoulombSlab.h +include/jdftx/core/CoulombWire.h +include/jdftx/core/Coulomb_ExchangeEval.h +include/jdftx/core/Coulomb_internal.h +include/jdftx/core/EnergyComponents.h +include/jdftx/core/GpuKernelUtils.h +include/jdftx/core/GpuUtil.h +include/jdftx/core/GridInfo.h +include/jdftx/core/H5io.h +include/jdftx/core/LatticeUtils.h +include/jdftx/core/LoopMacros.h +include/jdftx/core/MPIUtil.h +include/jdftx/core/ManagedMemory.h +include/jdftx/core/Minimize.h +include/jdftx/core/MinimizeParams.h +include/jdftx/core/Minimize_lBFGS.h +include/jdftx/core/Minimize_linmin.h +include/jdftx/core/Operators.h +include/jdftx/core/Operators_internal.h +include/jdftx/core/Pulay.h +include/jdftx/core/PulayParams.h +include/jdftx/core/RadialFunction.h +include/jdftx/core/Random.h +include/jdftx/core/ScalarField.h +include/jdftx/core/ScalarFieldArray.h +include/jdftx/core/ScalarFieldIO.h +include/jdftx/core/SphericalHarmonics.h +include/jdftx/core/Spline.h +include/jdftx/core/Thread.h +include/jdftx/core/Units.h +include/jdftx/core/Util.h +include/jdftx/core/VectorField.h +include/jdftx/core/WignerSeitz.h +include/jdftx/core/matrix.h +include/jdftx/core/matrix3.h +include/jdftx/core/scalar.h +include/jdftx/core/scaled.h +include/jdftx/core/string.h +include/jdftx/core/tensor3.h +include/jdftx/core/vector3.h +include/jdftx/electronic/BandDavidson.h +include/jdftx/electronic/BandMinimizer.h +include/jdftx/electronic/Basis.h +include/jdftx/electronic/ColumnBundle.h +include/jdftx/electronic/ColumnBundleOperators_internal.h +include/jdftx/electronic/ColumnBundleTransform.h +include/jdftx/electronic/Control.h +include/jdftx/electronic/DOS.h +include/jdftx/electronic/Dump.h +include/jdftx/electronic/Dump_internal.h +include/jdftx/electronic/ElecInfo.h +include/jdftx/electronic/ElecMinimizer.h +include/jdftx/electronic/ElecVars.h +include/jdftx/electronic/ElectronScattering.h +include/jdftx/electronic/Energies.h +include/jdftx/electronic/Everything.h +include/jdftx/electronic/ExCorr.h +include/jdftx/electronic/ExCorr_OrbitalDep_GLLBsc.h +include/jdftx/electronic/ExCorr_internal.h +include/jdftx/electronic/ExCorr_internal_GGA.h +include/jdftx/electronic/ExCorr_internal_LDA.h +include/jdftx/electronic/ExCorr_internal_mGGA.h +include/jdftx/electronic/ExactExchange.h +include/jdftx/electronic/IonDynamics.h +include/jdftx/electronic/IonDynamicsParams.h +include/jdftx/electronic/IonInfo.h +include/jdftx/electronic/IonicMinimizer.h +include/jdftx/electronic/LatticeMinimizer.h +include/jdftx/electronic/Polarizability.h +include/jdftx/electronic/RadialSchrodinger.h +include/jdftx/electronic/SCF.h +include/jdftx/electronic/SCFparams.h +include/jdftx/electronic/SpeciesInfo.h +include/jdftx/electronic/SpeciesInfo_internal.h +include/jdftx/electronic/Symmetries.h +include/jdftx/electronic/TetrahedralDOS.h +include/jdftx/electronic/VanDerWaals.h +include/jdftx/electronic/Vibrations.h +include/jdftx/electronic/symbols.h +include/jdftx/fluid/ConvCoupling.h +include/jdftx/fluid/ErfFMTweight.h +include/jdftx/fluid/Euler.h +include/jdftx/fluid/Fex.h +include/jdftx/fluid/Fex_H2O_BondedVoids.h +include/jdftx/fluid/Fex_H2O_FittedCorrelations.h +include/jdftx/fluid/Fex_H2O_FittedCorrelations_internal.h +include/jdftx/fluid/Fex_LJ.h +include/jdftx/fluid/Fex_ScalarEOS.h +include/jdftx/fluid/Fex_ScalarEOS_internal.h +include/jdftx/fluid/FluidComponent.h +include/jdftx/fluid/FluidMixture.h +include/jdftx/fluid/FluidSolver.h +include/jdftx/fluid/FluidSolverParams.h +include/jdftx/fluid/Fmix.h +include/jdftx/fluid/IdealGas.h +include/jdftx/fluid/IdealGasMonoatomic.h +include/jdftx/fluid/IdealGasMuEps.h +include/jdftx/fluid/IdealGasPomega.h +include/jdftx/fluid/IdealGasPsiAlpha.h +include/jdftx/fluid/LinearPCM.h +include/jdftx/fluid/MixedFMT.h +include/jdftx/fluid/MixedFMT_internal.h +include/jdftx/fluid/Molecule.h +include/jdftx/fluid/NonlinearPCM.h +include/jdftx/fluid/PCM.h +include/jdftx/fluid/PCM_internal.h +include/jdftx/fluid/S2quad.h +include/jdftx/fluid/SO3quad.h +include/jdftx/fluid/SaLSA.h +include/jdftx/fluid/TranslationOperator.h +include/jdftx/fluid/TranslationOperator_internal.h +include/jdftx/fluid/VDWCoupling.h +include/jdftx/phonon/Phonon.h +include/jdftx/wannier/Wannier.h +include/jdftx/wannier/WannierMinimizer.h +include/jdftx/wannier/WannierMinimizerFD.h +include/jdftx/wannier/WannierMinimizerRS.h lib/libjdftx.so %%DATADIR%%/pseudopotentials/GBRV/COPYING %%DATADIR%%/pseudopotentials/GBRV/README +%%DATADIR%%/pseudopotentials/GBRV/ag_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/ag_lda_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/ag_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/ag_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/ag_pbe_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/ag_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/ag_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/ag_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/al_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/al_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/al_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/al_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/al_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/al_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/as_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/as_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/as_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/as_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/as_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/as_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/au_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/au_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/au_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/au_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/au_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/au_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/b_lda.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.uspp %%DATADIR%%/pseudopotentials/GBRV/b_pbe_v1.01.uspp %%DATADIR%%/pseudopotentials/GBRV/b_pbe_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/b_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/b_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/ba_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/ba_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/ba_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/ba_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/ba_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/ba_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/be_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/be_lda_v1.2.uspp %%DATADIR%%/pseudopotentials/GBRV/be_lda_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/be_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/be_pbe_v1.2.uspp %%DATADIR%%/pseudopotentials/GBRV/be_pbe_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/be_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/be_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/bi_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/bi_lda_v1.uspp 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%%DATADIR%%/pseudopotentials/GBRV/cu_lda_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/cu_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/cu_pbe_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/cu_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/cu_pbesol_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/f_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/f_lda_v1.2.uspp %%DATADIR%%/pseudopotentials/GBRV/f_lda_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/f_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/f_pbe_v1.2.uspp %%DATADIR%%/pseudopotentials/GBRV/f_pbe_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/f_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/f_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/fe_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/fe_lda_v1.2.uspp %%DATADIR%%/pseudopotentials/GBRV/fe_lda_v1.5.uspp +%%DATADIR%%/pseudopotentials/GBRV/fe_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/fe_pbe_v1.2.uspp %%DATADIR%%/pseudopotentials/GBRV/fe_pbe_v1.5.uspp +%%DATADIR%%/pseudopotentials/GBRV/fe_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/fe_pbesol_v1.5.uspp +%%DATADIR%%/pseudopotentials/GBRV/ga_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/ga_lda_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/ga_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/ga_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/ga_pbe_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/ga_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/ga_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/ga_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/ge_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/ge_lda_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/ge_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/ge_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/ge_pbe_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/ge_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/ge_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/ge_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/h_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/h_lda_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/h_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/h_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/h_pbe_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/h_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/h_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/h_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/hf_lda.uspp +%%DATADIR%%/pseudopotentials/GBRV/hf_lda_plus4.uspp %%DATADIR%%/pseudopotentials/GBRV/hf_lda_plus4_v1.uspp %%DATADIR%%/pseudopotentials/GBRV/hf_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/hf_pbe.uspp +%%DATADIR%%/pseudopotentials/GBRV/hf_pbe_plus4.uspp %%DATADIR%%/pseudopotentials/GBRV/hf_pbe_plus4_v1.uspp %%DATADIR%%/pseudopotentials/GBRV/hf_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/hf_pbesol.uspp +%%DATADIR%%/pseudopotentials/GBRV/hf_pbesol_plus4.uspp %%DATADIR%%/pseudopotentials/GBRV/hf_pbesol_plus4_v1.uspp %%DATADIR%%/pseudopotentials/GBRV/hf_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/hg_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/hg_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/hg_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/hg_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/hg_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/hg_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/i_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/i_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/i_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/i_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/i_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/i_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/in_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/in_lda_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/in_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/in_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/in_pbe_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/in_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/in_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/in_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/ir_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/ir_lda_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/ir_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/ir_pbe_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/ir_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/ir_pbesol_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/k_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/k_lda_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/k_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/k_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/k_pbe_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/k_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/k_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/k_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/la_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/la_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/la_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/la_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/la_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/la_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/li_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/li_lda_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/li_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/li_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/li_pbe_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/li_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/li_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/li_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/mg_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/mg_lda_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/mg_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/mg_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/mg_pbe_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/mg_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/mg_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/mg_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/mn_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/mn_lda_v1.2.uspp %%DATADIR%%/pseudopotentials/GBRV/mn_lda_v1.5.uspp +%%DATADIR%%/pseudopotentials/GBRV/mn_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/mn_pbe_v1.2.uspp %%DATADIR%%/pseudopotentials/GBRV/mn_pbe_v1.5.uspp +%%DATADIR%%/pseudopotentials/GBRV/mn_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/mn_pbesol_v1.5.uspp +%%DATADIR%%/pseudopotentials/GBRV/mo_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/mo_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/mo_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/mo_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/mo_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/mo_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/n_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/n_lda_v1.2.uspp %%DATADIR%%/pseudopotentials/GBRV/n_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/n_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/n_pbe_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/n_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/n_pbesol_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/na_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/na_lda_v1.5.uspp %%DATADIR%%/pseudopotentials/GBRV/na_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/na_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/na_pbe_v1.5.uspp %%DATADIR%%/pseudopotentials/GBRV/na_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/na_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/na_pbesol_v1.5.uspp +%%DATADIR%%/pseudopotentials/GBRV/nb_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/nb_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/nb_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/nb_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/nb_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/nb_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/ni_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/ni_lda_v1.2.uspp %%DATADIR%%/pseudopotentials/GBRV/ni_lda_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/ni_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/ni_pbe_v1.2.uspp %%DATADIR%%/pseudopotentials/GBRV/ni_pbe_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/ni_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/ni_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/o_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/o_lda_v1.2.uspp %%DATADIR%%/pseudopotentials/GBRV/o_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/o_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/o_pbe_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/o_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/o_pbesol_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/os_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/os_lda_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/os_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/os_pbe_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/os_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/os_pbesol_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/p_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/p_lda_v1.5.uspp %%DATADIR%%/pseudopotentials/GBRV/p_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/p_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/p_pbe_v1.5.uspp %%DATADIR%%/pseudopotentials/GBRV/p_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/p_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/p_pbesol_v1.5.uspp +%%DATADIR%%/pseudopotentials/GBRV/pb_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/pb_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/pb_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/pb_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/pb_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/pb_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/pd_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/pd_lda_v1.2.uspp %%DATADIR%%/pseudopotentials/GBRV/pd_lda_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/pd_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/pd_pbe_v1.2.uspp %%DATADIR%%/pseudopotentials/GBRV/pd_pbe_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/pd_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/pd_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/pt_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/pt_lda_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/pt_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/pt_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/pt_pbe_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/pt_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/pt_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/pt_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/rb_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/rb_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/rb_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/rb_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/rb_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/rb_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/re_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/re_lda_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/re_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/re_pbe_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/re_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/re_pbesol_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/rh_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/rh_lda_v1.2.uspp %%DATADIR%%/pseudopotentials/GBRV/rh_lda_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/rh_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/rh_pbe_v1.2.uspp %%DATADIR%%/pseudopotentials/GBRV/rh_pbe_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/rh_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/rh_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/ru_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/ru_lda_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/ru_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/ru_pbe_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/ru_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/ru_pbesol_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/s_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/s_lda_v1.2.uspp %%DATADIR%%/pseudopotentials/GBRV/s_lda_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/s_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/s_pbe_v1.2.uspp %%DATADIR%%/pseudopotentials/GBRV/s_pbe_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/s_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/s_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/sb_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/sb_lda_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/sb_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/sb_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/sb_pbe_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/sb_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/sb_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/sb_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/sc_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/sc_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/sc_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/sc_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/sc_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/sc_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/se_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/se_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/se_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/se_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/se_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/se_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/si_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/si_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/si_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/si_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/si_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/si_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/sn_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/sn_lda_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/sn_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/sn_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/sn_pbe_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/sn_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/sn_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/sn_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/sr_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/sr_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/sr_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/sr_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/sr_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/sr_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/ta_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/ta_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/ta_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/ta_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/ta_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/ta_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/tc_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/tc_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/tc_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/tc_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/tc_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/tc_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/te_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/te_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/te_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/te_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/te_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/te_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/ti_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/ti_lda_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/ti_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/ti_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/ti_pbe_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/ti_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/ti_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/ti_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/tl_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/tl_lda_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/tl_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/tl_pbe_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/tl_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/tl_pbesol_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/v_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/v_lda_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/v_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/v_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/v_pbe_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/v_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/v_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/v_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/w_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/w_lda_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/w_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/w_pbe_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/w_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/w_pbesol_v1.2.uspp +%%DATADIR%%/pseudopotentials/GBRV/y_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/y_lda_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/y_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/y_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/y_pbe_v1.4.uspp %%DATADIR%%/pseudopotentials/GBRV/y_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/y_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/y_pbesol_v1.4.uspp +%%DATADIR%%/pseudopotentials/GBRV/zn_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/zn_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/zn_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/zn_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/zn_pbesol.uspp %%DATADIR%%/pseudopotentials/GBRV/zn_pbesol_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/zr_lda.uspp %%DATADIR%%/pseudopotentials/GBRV/zr_lda_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/zr_pbe.uspp %%DATADIR%%/pseudopotentials/GBRV/zr_pbe_v1.uspp +%%DATADIR%%/pseudopotentials/GBRV/zr_pbesol.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/Ag_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Ag_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Al_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Al_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Al_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Al_ONCV_PBE.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/Ar_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Ar_ONCV_PBE.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/As_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/As_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Au_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Au_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Au_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Au_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/B_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/B_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/B_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/B_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Ba_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Ba_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Ba_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Ba_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Be_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Be_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Be_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Be_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Bi_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Bi_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Bi_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Bi_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Br_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Br_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Br_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Br_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/C_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/C_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/C_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/C_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Ca_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Ca_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Ca_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Ca_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Cd_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Cd_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Cd_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Cd_ONCV_PBE.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/Cl_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Cl_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Co_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Co_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Co_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Co_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Cr_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Cr_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Cr_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Cr_ONCV_PBE.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/Cs_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Cs_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Cu_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Cu_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Cu_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Cu_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/F_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/F_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/F_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/F_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Fe_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Fe_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Fe_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Fe_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Ga_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Ga_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Ga_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Ga_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Ge_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Ge_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Ge_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Ge_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/H_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/H_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/H_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/H_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/He_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/He_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/He_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/He_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Hf_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Hf_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Hf_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Hf_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Hg_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Hg_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Hg_ONCV_PBE.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/I_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/I_ONCV_PBE.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/In_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/In_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Ir_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Ir_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Ir_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Ir_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/K_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/K_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/K_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/K_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Kr_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Kr_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Kr_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Kr_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/La_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/La_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/La_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/La_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Li_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Li_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Li_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Li_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Mg_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Mg_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Mg_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Mg_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Mn_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Mn_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Mn_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Mn_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Mo_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Mo_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Mo_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Mo_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/N_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/N_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/N_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/N_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Na_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Na_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Na_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Na_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Nb_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Nb_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Nb_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Nb_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Ne_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Ne_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Ne_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Ni_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Ni_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Ni_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Ni_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/O_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/O_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/O_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/O_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Os_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Os_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Os_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Os_ONCV_PBE.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/P_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/P_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Pb_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Pb_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Pb_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Pb_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Pd_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Pd_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Pd_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Pd_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Pt_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Pt_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Pt_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Pt_ONCV_PBE.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/Rb_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Rb_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Re_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Re_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Re_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Re_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Rh_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Rh_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Rh_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Rh_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Ru_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Ru_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Ru_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Ru_ONCV_PBE.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/S_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/S_ONCV_PBE.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/Sb_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Sb_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Sc_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Sc_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Sc_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Sc_ONCV_PBE.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/Se_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Se_ONCV_PBE.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/Si_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Si_ONCV_PBE.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/Sn_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Sn_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Sr_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Sr_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Sr_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Sr_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Ta_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Ta_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Ta_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Ta_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Tc_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Tc_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Tc_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Tc_ONCV_PBE.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/Te_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Te_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Ti_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Ti_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Ti_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Ti_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Tl_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Tl_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Tl_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Tl_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/V_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/V_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/V_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/V_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/W_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/W_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/W_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/W_ONCV_PBE.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/Xe_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Xe_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Y_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Y_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Y_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Y_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Zn_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Zn_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Zn_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Zn_ONCV_PBE.upf %%DATADIR%%/pseudopotentials/SG15/Zr_ONCV_PBE-1.0.pulay %%DATADIR%%/pseudopotentials/SG15/Zr_ONCV_PBE-1.0.upf +%%DATADIR%%/pseudopotentials/SG15/Zr_ONCV_PBE.pulay +%%DATADIR%%/pseudopotentials/SG15/Zr_ONCV_PBE.upf +%%DATADIR%%/scripts/ase/JDFTx.py +%%DATADIR%%/scripts/ase/README.txt +%%DATADIR%%/scripts/bandstructKpoints +%%DATADIR%%/scripts/binaryToText +%%DATADIR%%/scripts/calcPulay +%%DATADIR%%/scripts/createVASP +%%DATADIR%%/scripts/createXSF +%%DATADIR%%/scripts/dryRunToPDB +%%DATADIR%%/scripts/listEnergy +%%DATADIR%%/scripts/plotConvergence +%%DATADIR%%/scripts/printStackTrace +%%DATADIR%%/scripts/xyzToIonpos +%%DATADIR%%/scripts/xyzToIonposOpt