mirror of
https://git.FreeBSD.org/ports.git
synced 2025-01-08 06:48:28 +00:00
New port: science/xcrysden: Crystalline and molecular structure visualisation program
This commit is contained in:
Yuri Victorovich
parent
7fd82e7bea
commit
3aa3261c87
Notes:
svn2git
2021-03-31 03:12:20 +00:00
svn path=/head/; revision=474971
@ -247,6 +247,7 @@
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SUBDIR += v_sim
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SUBDIR += vmd
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SUBDIR += voro++
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SUBDIR += xcrysden
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SUBDIR += xfce4-equake-plugin
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SUBDIR += xmakemol
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33
science/xcrysden/Makefile
Normal file
33
science/xcrysden/Makefile
Normal file
@ -0,0 +1,33 @@
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# $FreeBSD$
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PORTNAME= xcrysden
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DISTVERSION= 1.5.60
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CATEGORIES= science
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MASTER_SITES= http://www.xcrysden.org/download/
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MAINTAINER= yuri@FreeBSD.org
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COMMENT= Crystalline and molecular structure visualisation program
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LICENSE= GPLv2
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LICENSE_FILE= ${WRKSRC}/COPYING
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LIB_DEPENDS= libfftw3.so:math/fftw3
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RUN_DEPENDS= bwidget>0:x11-toolkits/bwidget
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USES= fortran gmake localbase:ldflags tcl tk
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USE_GL= gl glu
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USE_XORG= x11 xmu
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BINARY_ALIAS= make=gmake gcc=cc gfortran=gfortran${GCC_DEFAULT}
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post-patch:
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@${CP} ${FILESDIR}/Make.sys ${WRKSRC}
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@${REINPLACE_CMD} -e 's|/usr/local|${LOCALBASE}|' ${WRKSRC}/Make.sys
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@${RM} -r ${WRKSRC}/external/src
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post-install:
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@cd ${STAGEDIR}${PREFIX}/lib/${PORTNAME} && ${STRIP_CMD} xcrys xctclsh xsf2xsf
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@${REINPLACE_CMD} -i '' -e 's|^\.|export LD_PRELOAD=/usr/local/lib/gcc${GCC_DEFAULT}/libgcc_s.so; .|' \
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${STAGEDIR}${PREFIX}/bin/xcrysden
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.include <bsd.port.mk>
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3
science/xcrysden/distinfo
Normal file
3
science/xcrysden/distinfo
Normal file
@ -0,0 +1,3 @@
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TIMESTAMP = 1532024371
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SHA256 (xcrysden-1.5.60.tar.gz) = a695729f1bb3e486b86a74106c06a392c8aca048dc6b0f20785c3c311cfb2ef4
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SIZE (xcrysden-1.5.60.tar.gz) = 2287050
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64
science/xcrysden/files/Make.sys
Normal file
64
science/xcrysden/files/Make.sys
Normal file
@ -0,0 +1,64 @@
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#########################################################################
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#
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# System-dependent definitions suitable for compiling xcrysden using
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# a system shared libraries (needs Tcl/Tk/GL/GLU/FFTW libraries)
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#
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########################################################################
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#------------------------------------------------------------------------
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# if you have a GNU make it is better to set the MAKE variable to point
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# to gnu make
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#------------------------------------------------------------------------
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MAKE = make
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#------------------------------------------------------------------------
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# compilers & flags
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#------------------------------------------------------------------------
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CFLAGS = -ffast-math -funroll-loops -fPIC -DUSE_FONTS -pedantic -Wall -DUSE_INTERP_RESULT
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CC = gcc -g
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#LDLIB = -ldl
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MATH = -lm -lc
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FFLAGS =
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FC = gfortran -fdefault-double-8 -fdefault-real-8 -O2
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#-------------------------------------------
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#debug options
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#CFLAGS = -g
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#-------------------------------------------
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#------------------------------------------------------------------------
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# X-libraries & include files
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#------------------------------------------------------------------------
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X_LIB = -lXmu -lX11
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X_INCDIR =
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#------------------------------------------------------------------------
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#
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# Libraries
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#
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TCL_LIB = -L/usr/local/lib -ltcl86
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TK_LIB = -L/usr/local/lib -ltk86
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GLU_LIB = -L/usr/local/lib -lGLU
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GL_LIB = -L/usr/local/lib -lGL
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FFTW3_LIB = -L/usr/local/lib -lfftw3
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EXT_LIB = -L/usr/local/lib -lgl2ps
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# this is only used for some testing purposes
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#MESCHACH_LIB = -lmeschach
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#
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# Include directories
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#
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TCL_INCDIR = -I/usr/local/include/tcl8.6
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TK_INCDIR = -I/usr/local/include/tk8.6
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GL_INCDIR = -I/usr/local/include
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FFTW3_INCDIR = -I/usr/local/include
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# this is only used for some testing purposes
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#MESCHACH_INCDIR =
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#------------------------------------------------------------------------
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50
science/xcrysden/files/patch-Makefile
Normal file
50
science/xcrysden/files/patch-Makefile
Normal file
@ -0,0 +1,50 @@
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--- Makefile.orig 2014-06-25 21:07:29 UTC
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+++ Makefile
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@@ -228,7 +228,7 @@ BIN_FILES = bin/
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prefix ?= /usr/local
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version := $(shell cat version)
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-xcrysden = xcrysden-$(version)
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+xcrysden = xcrysden
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install: xcrysden
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@echo
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@@ -238,27 +238,27 @@ install: xcrysden
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@echo "# "
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@echo "#-----"
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@echo
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- install -m755 -d $(prefix)/share/$(xcrysden)
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- cp -a $(IRON_ITEMS) $(prefix)/share/$(xcrysden)
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+ install -m755 -d $(DESTDIR)$(prefix)/share/$(xcrysden)
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+ cp -a $(IRON_ITEMS) $(DESTDIR)$(prefix)/share/$(xcrysden)
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\
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for subdir in Awk examples $(EXTERNAL_LIB_BWIDGET) images scripts Tcl util; do \
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if test -d $$subdir; then \
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- install -m755 -d $(prefix)/share/$(xcrysden)/$$subdir; \
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- cp -a $$subdir/* $(prefix)/share/$(xcrysden)/$$subdir; \
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+ install -m755 -d $(DESTDIR)$(prefix)/share/$(xcrysden)/$$subdir; \
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+ cp -a $$subdir/* $(DESTDIR)$(prefix)/share/$(xcrysden)/$$subdir; \
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fi; \
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done
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\
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- install -m755 -d $(prefix)/share/man/man1
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- install -m644 $(MAN_FILES) $(prefix)/share/man/man1/
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- gzip -f $(addprefix $(prefix)/share/man/man1/,$(MAN_PAGES))
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+ install -m755 -d $(DESTDIR)$(prefix)/man/man1
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+ install -m644 $(MAN_FILES) $(DESTDIR)$(prefix)/man/man1/
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+ gzip -f $(addprefix $(DESTDIR)$(prefix)/man/man1/,$(MAN_PAGES))
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\
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- install -m755 -d $(prefix)/lib/$(xcrysden)
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- install -m755 bin/* $(prefix)/lib/$(xcrysden)/
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+ install -m755 -d $(DESTDIR)$(prefix)/lib/$(xcrysden)
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+ install -m755 bin/* $(DESTDIR)$(prefix)/lib/$(xcrysden)/
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\
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prefix=$(prefix) xcrysden=$(xcrysden) sh sys_utils/wrappers.sh
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- if test ! -d $(prefix)/bin; then install -m755 -d $(prefix)/bin; fi
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+ if test ! -d $(DESTDIR)$(prefix)/bin; then install -m755 -d $(DESTDIR)$(prefix)/bin; fi
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for prog in $(PROGS); do \
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- install -m755 $$prog.wrapper $(prefix)/bin/$$prog; \
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+ install -m755 $$prog.wrapper $(DESTDIR)$(prefix)/bin/$$prog; \
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done
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5
science/xcrysden/pkg-descr
Normal file
5
science/xcrysden/pkg-descr
Normal file
@ -0,0 +1,5 @@
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XCrySDen is a crystalline and molecular structure visualisation program aiming
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at display of isosurfaces and contours, which can be superimposed on crystalline
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structures and interactively rotated and manipulated.
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WWW: http://www.xcrysden.org/
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374
science/xcrysden/pkg-plist
Normal file
374
science/xcrysden/pkg-plist
Normal file
@ -0,0 +1,374 @@
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bin/ptable
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bin/pwi2xsf
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bin/pwo2xsf
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bin/unitconv
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bin/xcrysden
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lib/xcrysden/atomlab
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lib/xcrysden/calplane
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lib/xcrysden/cube2xsf
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lib/xcrysden/fhi_coord2xcr
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lib/xcrysden/fhi_inpini2ftn34
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lib/xcrysden/fracCoor
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lib/xcrysden/fsReadBXSF
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lib/xcrysden/ftnunit
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lib/xcrysden/gengeom
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lib/xcrysden/kPath
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lib/xcrysden/multislab
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lib/xcrysden/nn
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lib/xcrysden/pwKPath
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lib/xcrysden/pwi2xsf
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lib/xcrysden/pwi2xsf_old
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lib/xcrysden/recvec
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lib/xcrysden/savestruct
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lib/xcrysden/str2xcr
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lib/xcrysden/wn_readbakgen
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lib/xcrysden/wn_readbands
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lib/xcrysden/xcrys
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lib/xcrysden/xctclsh
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lib/xcrysden/xsf2xsf
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man/man1/ptable.1.gz
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man/man1/pwi2xsf.1.gz
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man/man1/pwo2xsf.1.gz
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man/man1/unitconv.1.gz
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man/man1/xcrysden.1.gz
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%%DATADIR%%/Awk/getOV.awk
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%%DATADIR%%/Awk/ginp.awk
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%%DATADIR%%/Awk/in1.awk
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%%DATADIR%%/Awk/pwo_coortype.awk
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%%DATADIR%%/Tcl/Grapher.tcl
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%%DATADIR%%/Tcl/Makefile
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%%DATADIR%%/Tcl/Viewer.tcl
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%%DATADIR%%/Tcl/Xcrysden_resources
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%%DATADIR%%/Tcl/addOption.tcl
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%%DATADIR%%/Tcl/advGeom.tcl
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%%DATADIR%%/Tcl/advGeom2.tcl
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%%DATADIR%%/Tcl/atomLabels.tcl
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%%DATADIR%%/Tcl/auxil.tcl
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%%DATADIR%%/Tcl/band.tcl
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%%DATADIR%%/Tcl/bar.tcl
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%%DATADIR%%/Tcl/bwid.tcl
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%%DATADIR%%/Tcl/bxsfOpen.tcl
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%%DATADIR%%/Tcl/bz.tcl
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%%DATADIR%%/Tcl/check_package.tcl
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%%DATADIR%%/Tcl/colormenu.tcl
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%%DATADIR%%/Tcl/colors.tcl
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%%DATADIR%%/Tcl/configGrapher.tcl
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%%DATADIR%%/Tcl/custom-definitions
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%%DATADIR%%/Tcl/cxxAdvGeom.tcl
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%%DATADIR%%/Tcl/cygwin.tcl
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%%DATADIR%%/Tcl/difIsoSurf.tcl
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%%DATADIR%%/Tcl/dispModes.tcl
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%%DATADIR%%/Tcl/dos.tcl
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%%DATADIR%%/Tcl/dumpWindow.tcl
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%%DATADIR%%/Tcl/edit.tcl
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%%DATADIR%%/Tcl/fhiPreset.tcl
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%%DATADIR%%/Tcl/fileselect.tcl
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%%DATADIR%%/Tcl/find_package.tcl
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%%DATADIR%%/Tcl/fontWidget.tcl
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%%DATADIR%%/Tcl/forces.tcl
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%%DATADIR%%/Tcl/fs/FS_Main.tcl
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%%DATADIR%%/Tcl/fs/FS_Multi.tcl
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%%DATADIR%%/Tcl/fs/Makefile
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%%DATADIR%%/Tcl/fs/bandselect.tcl
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%%DATADIR%%/Tcl/fs/bandwidths.tcl
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%%DATADIR%%/Tcl/fs/genFSInit.tcl
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%%DATADIR%%/Tcl/fs/header.tcl
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%%DATADIR%%/Tcl/fs/interpolate.tcl
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%%DATADIR%%/Tcl/fs/tclIndex
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%%DATADIR%%/Tcl/fs/toolbox.tcl
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%%DATADIR%%/Tcl/fs/wnFS.tcl
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%%DATADIR%%/Tcl/fs/wnFSInit.tcl
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%%DATADIR%%/Tcl/fs/wnReadStruct.tcl
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%%DATADIR%%/Tcl/g98.tcl
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%%DATADIR%%/Tcl/genWidget.tcl
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%%DATADIR%%/Tcl/gengeom.tcl
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%%DATADIR%%/Tcl/gifAnim.tcl
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%%DATADIR%%/Tcl/glLight.tcl
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%%DATADIR%%/Tcl/glModParam.tcl
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%%DATADIR%%/Tcl/go2crys.tcl
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%%DATADIR%%/Tcl/grid.tcl
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%%DATADIR%%/Tcl/groupSel.tcl
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%%DATADIR%%/Tcl/groups.tcl
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%%DATADIR%%/Tcl/gzmat.tcl
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%%DATADIR%%/Tcl/hbonds.tcl
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%%DATADIR%%/Tcl/header.tcl
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%%DATADIR%%/Tcl/isoControl.tcl
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%%DATADIR%%/Tcl/isoRender.tcl
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%%DATADIR%%/Tcl/isoStuff.tcl
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%%DATADIR%%/Tcl/kLabels.tcl
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%%DATADIR%%/Tcl/kPath.tcl
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%%DATADIR%%/Tcl/loadAttributes.tcl
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%%DATADIR%%/Tcl/menu.tcl
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%%DATADIR%%/Tcl/modAtomAtrib.tcl
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%%DATADIR%%/Tcl/modify.tcl
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%%DATADIR%%/Tcl/movieEncoders.tcl
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%%DATADIR%%/Tcl/movieMaker.tcl
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%%DATADIR%%/Tcl/mpegParam.tcl
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%%DATADIR%%/Tcl/multiWid.tcl
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%%DATADIR%%/Tcl/newInput.tcl
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%%DATADIR%%/Tcl/number.tcl
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%%DATADIR%%/Tcl/openExtStruct.tcl
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%%DATADIR%%/Tcl/openGLpar.tcl
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%%DATADIR%%/Tcl/openInput.tcl
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%%DATADIR%%/Tcl/parseComLinArg.tcl
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%%DATADIR%%/Tcl/parseDataGrid.tcl
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%%DATADIR%%/Tcl/planeselect.tcl
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%%DATADIR%%/Tcl/popupMenu.tcl
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%%DATADIR%%/Tcl/print.tcl
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%%DATADIR%%/Tcl/printCanvas.tcl
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%%DATADIR%%/Tcl/propC95.tcl
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%%DATADIR%%/Tcl/propInit.tcl
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%%DATADIR%%/Tcl/propertyPlane.tcl
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%%DATADIR%%/Tcl/pseudoDen.tcl
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%%DATADIR%%/Tcl/ptable.tcl
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%%DATADIR%%/Tcl/pwPreset.tcl
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%%DATADIR%%/Tcl/read25.tcl
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%%DATADIR%%/Tcl/readParam.tcl
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%%DATADIR%%/Tcl/runC95.tcl
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%%DATADIR%%/Tcl/sInfo.tcl
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%%DATADIR%%/Tcl/saveState.tcl
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%%DATADIR%%/Tcl/scripting.tcl
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%%DATADIR%%/Tcl/scriptingAtomicLabels.tcl
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%%DATADIR%%/Tcl/scriptingFilter.tcl
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%%DATADIR%%/Tcl/scriptingMakeMovie.tcl
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%%DATADIR%%/Tcl/scriptingScalarField2D.tcl
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%%DATADIR%%/Tcl/scriptingScalarField3D.tcl
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%%DATADIR%%/Tcl/scroll.tcl
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%%DATADIR%%/Tcl/selection.tcl
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%%DATADIR%%/Tcl/setIsosurfArray.tcl
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%%DATADIR%%/Tcl/sizes.tcl
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%%DATADIR%%/Tcl/state.tcl
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%%DATADIR%%/Tcl/stereo.tcl
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%%DATADIR%%/Tcl/tclIndex
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%%DATADIR%%/Tcl/test.tcl
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%%DATADIR%%/Tcl/thermometer.tcl
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%%DATADIR%%/Tcl/toglZoom.tcl
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%%DATADIR%%/Tcl/undoAdvGeom.tcl
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%%DATADIR%%/Tcl/unmapWin.tcl
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%%DATADIR%%/Tcl/wigner.tcl
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%%DATADIR%%/Tcl/wnDensity.tcl
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%%DATADIR%%/Tcl/wnDetComOpt.tcl
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%%DATADIR%%/Tcl/wnKPath.tcl
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%%DATADIR%%/Tcl/wnMultiSlab.tcl
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%%DATADIR%%/Tcl/wnOpen.tcl
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%%DATADIR%%/Tcl/wnRunWIEN.tcl
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%%DATADIR%%/Tcl/wnSaveSFile.tcl
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%%DATADIR%%/Tcl/xcAbout.tcl
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%%DATADIR%%/Tcl/xcInit.tcl
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%%DATADIR%%/Tcl/xcInitLib.tcl
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||||
%%DATADIR%%/Tcl/xctr.tcl
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%%DATADIR%%/Tcl/xsfAnim.tcl
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%%DATADIR%%/Tcl/xsfOpen.tcl
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%%DATADIR%%/Tcl/xyz.tcl
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%%DATADIR%%/examples/CRYSTALxx_input_files/Pt322.r1
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%%DATADIR%%/examples/CRYSTALxx_input_files/Pt_fcc.r1
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||||
%%DATADIR%%/examples/CRYSTALxx_input_files/ZnS.r1
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||||
%%DATADIR%%/examples/CRYSTALxx_input_files/argonite.r1
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||||
%%DATADIR%%/examples/CRYSTALxx_input_files/calcite.r1
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||||
%%DATADIR%%/examples/CRYSTALxx_input_files/chabazite.r1
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||||
%%DATADIR%%/examples/CRYSTALxx_input_files/cluster.r1
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%%DATADIR%%/examples/CRYSTALxx_input_files/corundum.r1
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||||
%%DATADIR%%/examples/CRYSTALxx_input_files/cuprite.r1
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%%DATADIR%%/examples/CRYSTALxx_input_files/graphite.r1
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%%DATADIR%%/examples/CRYSTALxx_input_files/mgo.r1
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%%DATADIR%%/examples/CRYSTALxx_input_files/polymer.r1
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%%DATADIR%%/examples/CRYSTALxx_input_files/pyrite.r1
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%%DATADIR%%/examples/CRYSTALxx_input_files/rutile.r1
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%%DATADIR%%/examples/CRYSTALxx_input_files/urea.r1
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%%DATADIR%%/examples/CRYSTALxx_input_files/zro2.r1
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||||
%%DATADIR%%/examples/FHI98MD_files/GaAsSurface_coord.out
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%%DATADIR%%/examples/FHI98MD_files/GaAsSurface_inp.ini
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%%DATADIR%%/examples/FHI98MD_files/GaAs_inp.ini
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%%DATADIR%%/examples/FermiSurface/MgB2.bxsf.gz
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%%DATADIR%%/examples/FermiSurface/RhBulkFcc.bxsf.gz
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%%DATADIR%%/examples/GAUSSIAN_files/N2O_homo+lumo.cube.gz
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%%DATADIR%%/examples/GAUSSIAN_files/benzene-6CH3-OCH3.g98
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%%DATADIR%%/examples/GAUSSIAN_files/benzene.g98_out
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||||
%%DATADIR%%/examples/Makefile
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%%DATADIR%%/examples/PDB/bucky.pdb
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%%DATADIR%%/examples/PDB/cluster.pdb
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||||
%%DATADIR%%/examples/PDB/mol2.pdb
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%%DATADIR%%/examples/PWSCF_files/CH3Rh111.inp
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%%DATADIR%%/examples/PWSCF_files/CH3Rh111.out
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%%DATADIR%%/examples/PWSCF_files/EthAl001-2x2.inp
|
||||
%%DATADIR%%/examples/PWSCF_files/EthAl001-2x2.out
|
||||
%%DATADIR%%/examples/README
|
||||
%%DATADIR%%/examples/Scripting/ZnS_molsurf.xcrysden
|
||||
%%DATADIR%%/examples/Scripting/animation.tcl
|
||||
%%DATADIR%%/examples/Scripting/atomic_labels.tcl
|
||||
%%DATADIR%%/examples/Scripting/build_crystal.tcl
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||||
%%DATADIR%%/examples/Scripting/build_crystal.tcl.bck
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%%DATADIR%%/examples/Scripting/colorplane_animation.tcl
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||||
%%DATADIR%%/examples/Scripting/colorplane_animation.tcl.bck
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||||
%%DATADIR%%/examples/Scripting/contours.tcl
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||||
%%DATADIR%%/examples/Scripting/contours.tcl.bck
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||||
%%DATADIR%%/examples/Scripting/g98cube.tcl
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||||
%%DATADIR%%/examples/Scripting/g98cube_multiScript.tcl
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||||
%%DATADIR%%/examples/Scripting/isosurface+colorplane+print.tcl
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%%DATADIR%%/examples/Scripting/isosurface+colorplane+print.tcl.bck
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||||
%%DATADIR%%/examples/Scripting/movie.tcl
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||||
%%DATADIR%%/examples/Scripting/multiScript.tcl
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||||
%%DATADIR%%/examples/Scripting/multiScript.tcl.bck
|
||||
%%DATADIR%%/examples/Scripting/plot_all_MO.sh
|
||||
%%DATADIR%%/examples/Scripting/pw_filters.tcl
|
||||
%%DATADIR%%/examples/Scripting/pwofilter.tcl
|
||||
%%DATADIR%%/examples/WIEN_struct_files/a-quartz.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/al2o3.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/b12.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/bi.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/cab6.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/cd16te15sb.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/cd8te7sb.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/coo.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/cos2.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/cr2o3.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/crb2.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/fe2p.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/fe4n.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/fecl2.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/fef2.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/ferrocen.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/gaas.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/in2o3.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/mos2.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/pt.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/si111.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/tellur.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/ybco7.struct
|
||||
%%DATADIR%%/examples/WIEN_struct_files/yfe2.struct
|
||||
%%DATADIR%%/examples/XSF_Files/1.xsf
|
||||
%%DATADIR%%/examples/XSF_Files/1symb.xsf
|
||||
%%DATADIR%%/examples/XSF_Files/2.xsf
|
||||
%%DATADIR%%/examples/XSF_Files/ANIM.axsf
|
||||
%%DATADIR%%/examples/XSF_Files/ANIMsymb.axsf
|
||||
%%DATADIR%%/examples/XSF_Files/CO_homo.xsf.gz
|
||||
%%DATADIR%%/examples/XSF_Files/CO_lumo.xsf.gz
|
||||
%%DATADIR%%/examples/XSF_Files/GaAsH.xsf
|
||||
%%DATADIR%%/examples/XSF_Files/README
|
||||
%%DATADIR%%/examples/XSF_Files/ZnS.xsf
|
||||
%%DATADIR%%/examples/XSF_Files/ZnS_variable-cell.axsf
|
||||
%%DATADIR%%/examples/XSF_Files/bucky.xsf
|
||||
%%DATADIR%%/examples/XSF_Files/c2h4:Ag001.xsf
|
||||
%%DATADIR%%/examples/XSF_Files/fcc-410-1x1.xsf
|
||||
%%DATADIR%%/examples/XSF_Files/mol-urea.xsf.gz
|
||||
%%DATADIR%%/examples/XSF_Files/mol-urea2D.xsf
|
||||
%%DATADIR%%/examples/XSF_Files/oxirane_homo.xsf.gz
|
||||
%%DATADIR%%/examples/XSF_Files/vector_field.xsf
|
||||
%%DATADIR%%/examples/XSF_Files/zro2cluster.xsf
|
||||
%%DATADIR%%/examples/XYZ/anim.xyz
|
||||
%%DATADIR%%/examples/XYZ/bucky.xyz
|
||||
%%DATADIR%%/examples/XYZ/mol1.xyz
|
||||
%%DATADIR%%/examples/XYZ/mol2.xyz
|
||||
%%DATADIR%%/images/ak.gif
|
||||
%%DATADIR%%/images/backward.gif
|
||||
%%DATADIR%%/images/ballsticks1_2d.gif
|
||||
%%DATADIR%%/images/ballsticks2_2d.gif
|
||||
%%DATADIR%%/images/ballsticks_3d.gif
|
||||
%%DATADIR%%/images/bold.xbm
|
||||
%%DATADIR%%/images/bz.gif
|
||||
%%DATADIR%%/images/camera-photo.gif
|
||||
%%DATADIR%%/images/cell.gif
|
||||
%%DATADIR%%/images/center1.gif
|
||||
%%DATADIR%%/images/center_nice.gif
|
||||
%%DATADIR%%/images/datagrid.gif
|
||||
%%DATADIR%%/images/dm_anaglyph.gif
|
||||
%%DATADIR%%/images/dm_flat.gif
|
||||
%%DATADIR%%/images/dm_smooth.gif
|
||||
%%DATADIR%%/images/dm_solid.gif
|
||||
%%DATADIR%%/images/dm_stereo.gif
|
||||
%%DATADIR%%/images/dm_wire.gif
|
||||
%%DATADIR%%/images/dot1x3H.bmp
|
||||
%%DATADIR%%/images/dot1x3V.bmp
|
||||
%%DATADIR%%/images/dotH.bmp
|
||||
%%DATADIR%%/images/dotV.bmp
|
||||
%%DATADIR%%/images/down.gif
|
||||
%%DATADIR%%/images/down1.gif
|
||||
%%DATADIR%%/images/first.gif
|
||||
%%DATADIR%%/images/forward.gif
|
||||
%%DATADIR%%/images/italic.xbm
|
||||
%%DATADIR%%/images/jpaint.gif
|
||||
%%DATADIR%%/images/last.gif
|
||||
%%DATADIR%%/images/left1.gif
|
||||
%%DATADIR%%/images/mini-colors.gif
|
||||
%%DATADIR%%/images/next.gif
|
||||
%%DATADIR%%/images/nocell.gif
|
||||
%%DATADIR%%/images/nocrop.gif
|
||||
%%DATADIR%%/images/overstrike.xbm
|
||||
%%DATADIR%%/images/pause.gif
|
||||
%%DATADIR%%/images/pipeballs_2d.gif
|
||||
%%DATADIR%%/images/pipeballs_3d.gif
|
||||
%%DATADIR%%/images/pointlines_2d.gif
|
||||
%%DATADIR%%/images/previous.gif
|
||||
%%DATADIR%%/images/printer.gif
|
||||
%%DATADIR%%/images/rep_asym.gif
|
||||
%%DATADIR%%/images/rep_unit.gif
|
||||
%%DATADIR%%/images/right.gif
|
||||
%%DATADIR%%/images/right1.gif
|
||||
%%DATADIR%%/images/rotAB.gif
|
||||
%%DATADIR%%/images/rotAC.gif
|
||||
%%DATADIR%%/images/rotBC.gif
|
||||
%%DATADIR%%/images/rotXY1.gif
|
||||
%%DATADIR%%/images/rotXZ1.gif
|
||||
%%DATADIR%%/images/rotXmin.gif
|
||||
%%DATADIR%%/images/rotXplus.gif
|
||||
%%DATADIR%%/images/rotYZ1.gif
|
||||
%%DATADIR%%/images/rotYmin.gif
|
||||
%%DATADIR%%/images/rotYplus.gif
|
||||
%%DATADIR%%/images/rotZmin.gif
|
||||
%%DATADIR%%/images/rotZplus.gif
|
||||
%%DATADIR%%/images/solidcell.gif
|
||||
%%DATADIR%%/images/solidwirecell.gif
|
||||
%%DATADIR%%/images/spacefills_2d.gif
|
||||
%%DATADIR%%/images/spacefills_3d.gif
|
||||
%%DATADIR%%/images/sticks_3d.gif
|
||||
%%DATADIR%%/images/stop.gif
|
||||
%%DATADIR%%/images/underline.xbm
|
||||
%%DATADIR%%/images/unmap-C95output.gif
|
||||
%%DATADIR%%/images/unmap-empty.gif
|
||||
%%DATADIR%%/images/unmap-isosurface.gif
|
||||
%%DATADIR%%/images/unmap.gif
|
||||
%%DATADIR%%/images/up.gif
|
||||
%%DATADIR%%/images/up1.gif
|
||||
%%DATADIR%%/images/wait.xbm
|
||||
%%DATADIR%%/images/wirecell.gif
|
||||
%%DATADIR%%/images/wireframes_2d.gif
|
||||
%%DATADIR%%/images/xcAbout.gif
|
||||
%%DATADIR%%/images/xcMenuEntry_down.xbm
|
||||
%%DATADIR%%/images/xcMenuEntry_up.xbm
|
||||
%%DATADIR%%/images/xcPrintCanvas_left.xbm
|
||||
%%DATADIR%%/images/xcPrintCanvas_right.xbm
|
||||
%%DATADIR%%/images/xcrysden-welcome.gif
|
||||
%%DATADIR%%/images/xcrysden.gif
|
||||
%%DATADIR%%/images/xcrysden.png
|
||||
%%DATADIR%%/images/xcrysden.xbm
|
||||
%%DATADIR%%/images/xcrysden.xpm
|
||||
%%DATADIR%%/images/xcrysden_big.gif
|
||||
%%DATADIR%%/images/xcrysden_kpath.gif
|
||||
%%DATADIR%%/images/xcrysden_mask.xbm
|
||||
%%DATADIR%%/images/zoomdown.gif
|
||||
%%DATADIR%%/images/zoomup.gif
|
||||
%%DATADIR%%/images/zoomup.xbm
|
||||
%%DATADIR%%/scripts/dummy.sh
|
||||
%%DATADIR%%/scripts/g98toxsf.sh
|
||||
%%DATADIR%%/scripts/gzmat2xsf.sh
|
||||
%%DATADIR%%/scripts/launch.sh
|
||||
%%DATADIR%%/scripts/pwGetNC.sh
|
||||
%%DATADIR%%/scripts/pwLib_old.sh
|
||||
%%DATADIR%%/scripts/pwd.sh
|
||||
%%DATADIR%%/scripts/pwi2xsf.sh
|
||||
%%DATADIR%%/scripts/pwo2xsf.sh
|
||||
%%DATADIR%%/scripts/pwo2xsf_anim.awk
|
||||
%%DATADIR%%/scripts/pwo2xsf_neb.awk
|
||||
%%DATADIR%%/scripts/pwo2xsf_old.sh
|
||||
%%DATADIR%%/scripts/pwo2xsf_opt.awk
|
||||
%%DATADIR%%/scripts/xcConfigure.sh
|
||||
%%DATADIR%%/scripts/xcConfigure_definitions.sh
|
||||
%%DATADIR%%/scripts/xcConfigure_updateProfile.sh
|
||||
%%DATADIR%%/scripts/xcLib.sh
|
||||
%%DATADIR%%/scripts/xc_cleanscratch
|
||||
%%DATADIR%%/usage
|
||||
%%DATADIR%%/util/ptable
|
||||
%%DATADIR%%/util/tcl_index
|
||||
%%DATADIR%%/util/unitconv
|
||||
%%DATADIR%%/version
|
||||
%%DATADIR%%/xcrysden
|
||||
Loading…
Reference in New Issue
Block a user