========================================================================
                  DENCHAR CHANGES: TOP IS MOST RECENT

CHANGES ARE NOW RECORDED IN MAIN CHANGES FILE in top Docs directory

=======================================================================
April 1, 2009
Denchar source is back in its own Util directory
Author: Alberto Garcia <albertog@icmab.es>

=======================================================================
Version: 1.3
Date: 2004/02/01 18:00
Title: Denchar moved to top source directory !
Author: Alberto Garcia <wdpgaara@lg.ehu.es>

Description: Denchar now lives in the top source directory. 
             The manual and Examples are stil under Util/Denchar.

=======================================================================
Version: 1.2.1
Date: 2003/07/22  14:45 
Title: Bug in output corrected
Author: Pablo Ordejon  <ordejon@icmab.es>

Description: 

 Two small bugs in the writting out has been corrected.

Files:

  Src/wrout.F:  bug corrected
  Src/itochar.f:  bug corrected
  CHANGES, denchar.tex: Customary changes
=======================================================================
Version: 1.2.0
Date: 2003/07/03  18:30 
Title: Capability for 3D and wavefunction plots
Author: Pablo Ordejon  <ordejon@icmab.es>

Description:

  Denchar has extended its capabilities to:
 1) Produce 3D plots (in the form of Gaussian Cube files)
 2) Plot wavefunctions read from Siesta

Files: 

   Src/atompla.f
   Src/chemical.f
   Src/denchar.F
   Src/iodm.F
   Src/itochar.f    <--- new file
   Src/Makefile 
   Src/planed.f
   Src/readpla.f
   Src/readwaves.f  <--- new file
   Src/redata.f
   Src/rhoofr.f
   Src/wavofr.f     <--- new file
   Src/wrout.f
   Docs/denchar.tex
   Docs/CHANGES
   Examples/AtomicIndices.fdf
   Examples/NormalVector.fdf
   Examples/ThreePoints.fdf
   Examples/TwoLines.fdf
   Tests/Si/Si.fdf   <--- removed    
   Tests/Si/Si.psf   <--- removed    
   Tests/Si/Si.ion   <--- removed    
   Tests/Si/Si.CON.DEL   <--- removed    
   Tests/Si/Si.CON.SCF   <--- removed    
   Tests/Si/2D     <--- new directory
   Tests/Si/2D/contour.gplot     <--- new file
   Tests/Si/2D/Si.CON.DEL        <--- new file
   Tests/Si/2D/Si.CON.SCF        <--- new file
   Tests/Si/2D/Si.CON.WF1        <--- new file
   Tests/Si/2D/Si.CON.WF2        <--- new file
   Tests/Si/2D/Si.CON.WF3        <--- new file
   Tests/Si/2D/Si.CON.WF4        <--- new file
   Tests/Si/2D/Si.CON.WF5        <--- new file
   Tests/Si/2D/Si.CON.WF6        <--- new file
   Tests/Si/2D/Si.CON.WF7        <--- new file
   Tests/Si/2D/Si.CON.WF8        <--- new file
   Tests/Si/2D/Si.fdf            <--- new file
   Tests/Si/2D/Si.psf            <--- new file
   Tests/Si/3D     <--- new directory
   Tests/Si/3D/Si.DRHO.cube      <--- new file
   Tests/Si/3D/Si.RHO.cube       <--- new file
   Tests/Si/3D/Si.WF1.cube       <--- new file
   Tests/Si/3D/Si.WF2.cube       <--- new file
   Tests/Si/3D/Si.WF3.cube       <--- new file
   Tests/Si/3D/Si.WF4.cube       <--- new file
   Tests/Si/3D/Si.WF5.cube       <--- new file
   Tests/Si/3D/Si.WF6.cube       <--- new file
   Tests/Si/3D/Si.WF7.cube       <--- new file
   Tests/Si/3D/Si.WF8.cube       <--- new file
   Tests/Si/3D/Si.fdf            <--- new file
   Tests/Si/3D/Si.psf            <--- new file
   Tests/SiH3/SiH3.fdf   <--- removed    
   Tests/SiH3/H.psf   <--- removed    
   Tests/SiH3/Si.psf   <--- removed    
   Tests/SiH3/SiH3.CON.DEL   <--- removed    
   Tests/SiH3/SiH3.CON.UP   <--- removed    
   Tests/SiH3/SiH3.CON.DOWN   <--- removed    
   Tests/SiH3/SiH3.CON.MAG   <--- removed    
   Tests/SiH3/2D    <--- new directory
   Tests/SiH3/SiH3.CON.DEL       <--- new file
   Tests/SiH3/SiH3.CON.DOWN      <--- new file
   Tests/SiH3/SiH3.CON.MAG       <--- new file
   Tests/SiH3/SiH3.CON.UP        <--- new file
   Tests/SiH3/SiH3.CON.WF1.UP    <--- new file
   Tests/SiH3/SiH3.CON.WF1.DOWN  <--- new file
   Tests/SiH3/SiH3.CON.WF2.UP    <--- new file
   Tests/SiH3/SiH3.CON.WF2.DOWN  <--- new file
   Tests/SiH3/SiH3.CON.WF3.UP    <--- new file
   Tests/SiH3/SiH3.CON.WF3.DOWN  <--- new file
   Tests/SiH3/SiH3.CON.WF4.UP    <--- new file
   Tests/SiH3/SiH3.CON.WF4.DOWN  <--- new file
   Tests/SiH3/SiH3.CON.WF5.UP    <--- new file
   Tests/SiH3/SiH3.CON.WF5.DOWN  <--- new file
   Tests/SiH3/SiH3.CON.WF6.UP    <--- new file
   Tests/SiH3/SiH3.CON.WF6.DOWN  <--- new file
   Tests/SiH3/H.psf              <--- new file
   Tests/SiH3/Si.psf             <--- new file
   Tests/SiH3/Si.fdf             <--- new file
   Tests/SiH3/3D    <--- new directory
   Tests/SiH3/3D/SiH3.DRHO.cube      <--- new file
   Tests/SiH3/3D/SiH3.RHO.DOWN.cube  <--- new file
   Tests/SiH3/3D/SiH3.RHO.UP.cube    <--- new file
   Tests/SiH3/3D/SiH3.WF5.DOWN.cube  <--- new file
   Tests/SiH3/3D/SiH3.WF5.UP.cube    <--- new file
   Tests/SiH3/3D/H.psf               <--- new file
   Tests/SiH3/3D/Si.psf              <--- new file
   Tests/SiH3/3D/SiH3.fdf            <--- new file


===============================================================================
Version: 1.1.0
Date: 2002/02/04  16:00 GMT
Title: F90 Denchar Implementation, Compatible with Siesta-1.2.5 
Author: Javier Junquera  <Javier.Junquera@ulg.ac.be>

Description:

   A F90 implementation of Denchar code has been done.
 It included all the atomic routines by A. Garcia needed
 to read the basis from files.
 

Files: We import the following files

   Src/atmfuncs.f
   Src/atmparams.f
   Src/atm_types.f
   Src/atompla.f
   Src/basis_io.F
   Src/bessph.f
   Src/bsd.f
   Src/chkdim.f
   Src/colinear.f
   Src/denchar.F
   Src/dismin.f
   Src/dmna.f
   Src/dot.f
   Src/iodm.F
   Src/io.f
   Src/ionew.F
   Src/length.f
   Src/listsc.f
   Src/matvect.f
   Src/memory.F
   Src/memoryinfo.F
   Src/neighb.f
   Src/parallel.f
   Src/paste.f
   Src/planed.f
   Src/precision.F
   Src/prmem.f
   Src/radfft.f
   Src/radial.f
   Src/ranger.f
   Src/readpla.f
   Src/recipes.f
   Src/redata.f
   Src/reinit.f
   Src/rhoofr.f
   Src/spher_harm.f
   Src/sys.F
   Src/version.F
   Src/volcel.f
   Src/wrout.f
   Docs/denchar.tex
   Docs/CHANGES
   Examples/AtomicIndices.fdf
   Examples/NormalVector.fdf
   Examples/ThreePoints.fdf
   Examples/TwoLines.fdf
   Test/Si/Si.fdf
   Test/Si/Si.psf
   Test/Si/Si.ion
   Test/Si/Si.CON.DEL
   Test/Si/Si.CON.SCF
   Test/SiH3/SiH3.fdf
   Test/SiH3/H.psf
   Test/SiH3/Si.psf
   Test/SiH3/SiH3.CON.DEL
   Test/SiH3/SiH3.CON.UP
   Test/SiH3/SiH3.CON.DOWN
   Test/SiH3/SiH3.CON.MAG

===============================================================================
   
       
   
       
