Changeset 2909 for branches/2.1.x/ChangeLog

Timestamp:

05/12/07 11:38:46 (20 months ago)

Author:

lorenzen

Message:

Release preparations:

* Removal of the Texinfo manual. Instead, a PDF version of the Wiki manual

is included in the distribution.

* Updated the README and NEWS files.
* Small fix in the RPM generation concerning the documentation files.
* Updated the ChangeLog? (more to test svn2cl.sh, it will have to be done

once more anyway).

Files:

• branches/2.1.x/ChangeLog (modified) (1 diff)

branches/2.1.x/ChangeLog

@@ -1 @@
-2006-02-16 23:22  appel
-
-        * AUTHORS: Adding current e-mail addresses.
-
-2006-02-16 17:23  marques
-
-        * AUTHORS: updated list
-
-2006-02-16 16:50  marques
-
-        * external_libs/: expokit/COPYING, expokit/Copyright,
-          metis-4.0/COPYING, metis-4.0/Copyright: Changed filenames from
-          Copyright COPYING
-
-2006-02-16 16:49  marques
-
-        * configure.ac, liboct/Makefile.am, liboct/oct_f.c,
-          build/acx_metis.m4, src/Makefile.am,
-          external_libs/metis-4.0/Makefile.am: *) Metis is now only
-          compiled when needed *) changed version number to 2.0 *) octopus
-          fails a couple of tests in my machine. I will take a look before
-          committing
-
-2006-02-16 16:02  appel
-
-        * liboct/: Makefile.am, oct_f.c: The header file metis.h was still
-          included as <metis/metis.h>. Now we use the one that we ship in
-          external_libs.
-
-2006-02-16 12:37  appel
-
-        * debian/changelog: Switching from 1.99devel to 2.0 for the
-          upcoming release.
-
-2006-02-16 12:36  appel
-
-        * configure.ac, build/acx_metis.m4: I forgot to treat the
-          HAVE_METIS properly, when I added the library to external_libs.
-          Now HAVE_METIS is enabled by default, but can be disabled with
-          --disable-metis at configure time.
-
-2006-02-13 16:58  acastro
-
-        * src/spectrum.F90: Bug fixed.  The units were not properly handled
-          in the cross_section_tensor subroutine.
-
-2006-02-12 23:13  acastro
-
-        * testsuite/rc_bugs/12-spin: Bug added.  Sorry, but I had to add
-          another bug, I think that it is important.  See the explanation
-          in the file. I will try to think about it the next days, to solve
-          it asap.
-
-2006-02-09 23:38  appel
-
-        * src/liboct_parser.F90: o Adding the full filename to the
-          variables error message.  o Removing stdin stuff completely.
-
-2006-02-09 23:32  appel
-
-        * Makefile.am: There was a line continuation \ missing. During make
-          install the share and testsuite directories have not been taken
-          into account.
-
-2006-02-09 22:49  appel
-
-        * src/out.F90: The compilation failed when using --with-netcdf. The
-          netcdf module doesn't have _m. Too much Perl :) ...
-
-2006-02-09 21:43  appel
-
-        * COPYING: Updating the top-level license file to account for
-          Expokit and Metis as 'external libraries'. I explicitely state in
-          the text, that both are _not_ GPL.
-
-          Please have a look if you agree with the style.
-
-2006-02-09 21:39  appel
-
-        * Makefile.am, configure.ac, external_libs/Makefile.am,
-          external_libs/expokit/Copyright,
-          external_libs/expokit/Makefile.am,
-          external_libs/expokit/expokit.f90, src/Makefile.am,
-          external_libs/metis-4.0/Copyright,
-          external_libs/metis-4.0/Makefile.am,
-          external_libs/metis-4.0/balance.c,
-          external_libs/metis-4.0/bucketsort.c,
-          external_libs/metis-4.0/ccgraph.c,
-          external_libs/metis-4.0/coarsen.c,
-          external_libs/metis-4.0/compress.c,
-          external_libs/metis-4.0/debug.c, external_libs/metis-4.0/defs.h,
-          external_libs/metis-4.0/estmem.c, external_libs/metis-4.0/fm.c,
-          external_libs/metis-4.0/fortran.c,
-          external_libs/metis-4.0/frename.c,
-          external_libs/metis-4.0/graph.c,
-          external_libs/metis-4.0/initpart.c,
-          external_libs/metis-4.0/kmetis.c,
-          external_libs/metis-4.0/kvmetis.c,
-          external_libs/metis-4.0/kwayfm.c,
-          external_libs/metis-4.0/kwayrefine.c,
-          external_libs/metis-4.0/kwayvolfm.c,
-          external_libs/metis-4.0/kwayvolrefine.c,
-          external_libs/metis-4.0/macros.h,
-          external_libs/metis-4.0/match.c,
-          external_libs/metis-4.0/mbalance.c,
-          external_libs/metis-4.0/mbalance2.c,
-          external_libs/metis-4.0/mcoarsen.c,
-          external_libs/metis-4.0/memory.c, external_libs/metis-4.0/mesh.c,
-          external_libs/metis-4.0/meshpart.c,
-          external_libs/metis-4.0/metis.h, external_libs/metis-4.0/mfm.c,
-          external_libs/metis-4.0/mfm2.c,
-          external_libs/metis-4.0/mincover.c,
-          external_libs/metis-4.0/minitpart.c,
-          external_libs/metis-4.0/minitpart2.c,
-          external_libs/metis-4.0/mkmetis.c,
-          external_libs/metis-4.0/mkwayfmh.c,
-          external_libs/metis-4.0/mkwayrefine.c,
-          external_libs/metis-4.0/mmatch.c, external_libs/metis-4.0/mmd.c,
-          external_libs/metis-4.0/mpmetis.c,
-          external_libs/metis-4.0/mrefine.c,
-          external_libs/metis-4.0/mrefine2.c,
-          external_libs/metis-4.0/mutil.c,
-          external_libs/metis-4.0/myqsort.c,
-          external_libs/metis-4.0/ometis.c,
-          external_libs/metis-4.0/parmetis.c,
-          external_libs/metis-4.0/pmetis.c,
-          external_libs/metis-4.0/pqueue.c,
-          external_libs/metis-4.0/proto.h,
-          external_libs/metis-4.0/refine.c,
-          external_libs/metis-4.0/rename.h,
-          external_libs/metis-4.0/separator.c,
-          external_libs/metis-4.0/sfm.c, external_libs/metis-4.0/srefine.c,
-          external_libs/metis-4.0/stat.c, external_libs/metis-4.0/struct.h,
-          external_libs/metis-4.0/subdomains.c,
-          external_libs/metis-4.0/timing.c, external_libs/metis-4.0/util.c:
-          Both, Expokit and the Metis library are now declared as external
-          libraries. The build system has been adapted accordingly to
-          reflect this change.
-
-          The inclusion of Metis should now finally solve the build
-          problems, that people were encountering frequently with the MPI
-          executable.
-
-2006-02-09 21:34  acastro
-
-        * src/: par_vec.F90, simul_box.F90: Bug fixed.  Just an absolute
-          value, but it created some awful problems.  I also put an ASSERT
-          in par_vec at a point where, if it had been before, it would have
-          saved me quite a few hours to debug. Maybe it is useful in the
-          future.  This bug was pointed out by some Carlo Camilloni.
-
-2006-02-09 21:08  appel
-
-        * src/: atomic.F90, blas.F90, broad.F90, casida.F90,
-          centergeom.F90, cf.F90, cf_inc.F90, cross_section.F90,
-          crystal.F90, curv_briggs.F90, curv_gygi.F90, curv_modine.F90,
-          curvlinear.F90, datasets.F90, derivatives.F90,
-          derivatives_inc.F90, eigen.F90, eigen_arpack.F90, eigen_cg.F90,
-          eigen_evolution.F90, eigen_plan.F90, eigen_trlan.F90, epot.F90,
-          epot_inc.F90, f.F90, f_inc.F90, fftw2.F90, fftw3.F90,
-          geom_opt.F90, geometry.F90, global.F90, grid.F90, gs.F90, h.F90,
-          h_inc.F90, h_so.F90, hgh.F90, hs.F90, io.F90, lasers.F90,
-          lcao.F90, liboct.F90, liboct_parser.F90, libxc.F90,
-          linalg_adv.F90, linalg_basic.F90, linear_response.F90,
-          linear_response_inc.F90, logrid.F90, main.F90, math.F90,
-          mesh.F90, mesh_init.F90, mesh_lib.F90, messages.F90, mf.F90,
-          mf_inc.F90, mix.F90, mpi.F90, mpi_debug.F90, multicomm.F90,
-          multigrid.F90, nl_operator.F90, ode_solver.F90,
-          ode_solver_inc.F90, opt_control.F90, out.F90, out_inc.F90,
-          par_vec.F90, par_vec_inc.F90, pes.F90, pes_mask.F90, pes_rc.F90,
-          phonon_spectrum.F90, phonons.F90, poisson.F90, poisson1D.F90,
-          poisson2D.F90, poisson3D.F90, poisson_cg.F90,
-          poisson_corrections.F90, poisson_multigrid.F90, profiling.F90,
-          ps.F90, pulpo.F90, restart.F90, restart_inc.F90, root_solver.F90,
-          root_solver_inc.F90, rotational_strength.F90, run.F90,
-          scalar_mesh.F90, scf.F90, simul_box.F90, sparskit.F90,
-          sparskit_driver.F90, sparskit_inc.F90, specie.F90, spectrum.F90,
-          spline.F90, states.F90, states_inc.F90, states_kpoints.F90,
-          static_pol.F90, static_pol_lr.F90, stencil_cube.F90,
-          stencil_star.F90, stencil_starplus.F90, stencil_variational.F90,
-          string.F90, systm.F90, td.F90, td_calc.F90, td_exp.F90,
-          td_exp_split.F90, td_init.F90, td_rti.F90, td_write.F90, tm.F90,
-          units.F90, unocc.F90, v_ks.F90, v_ks_inc.F90, varinfo.F90,
-          wave_matching.F90, xc.F90, xc_KLI.F90, xc_OEP.F90,
-          xc_OEP_SIC.F90, xc_OEP_inc.F90, xc_OEP_x.F90, xc_axc.F90,
-          xc_functl.F90, xc_fxc.F90, xc_kxc.F90, xc_vxc.F90,
-          xyz_adjust.F90, xyz_file.F90, xyzanim.F90: The MVAPICH
-          implementation has serious I/O problems when one of the modules
-          in the code is called 'system'. Besides the problem with reading
-          from stdin, this was the main issue in Sahu's problem report. I
-          spent more than a day to figure this out. Also thanks again to
-          Sahu for his patience, while we were debugging this issue.
-
-          As there were some thoughts on this previously, I take the
-          opportunity to rename all modules according to
-
-           sample/sample_mod  ->  sample_m
-
-          Similarly all types have been converted according to
-
-           sample_type  ->  sample_t
-
-          This is actually Linux kernel convention :).
-
-2006-02-09 19:13  appel
-
-        * src/liboct_parser.F90: Some MPI implementations, e.g. the MVAPICH
-          implementation for infiniband interconnects, do not forward stdin
-          to all compute nodes. This problem was initially reported by Sahu
-          on the octopus-users mailing list and recently showed up in a
-          second posting.
-
-          Reading the input file from stdin via e.g.
-
-           octopus < Na2
-
-          is now disabled. This caused too many confusions, even in the
-          serial case.  Often people already had a file with name 'inp' in
-          the working directory while trying to read the input via '<'. In
-          that case they got tricked by the precedence.
-
-          Octopus is now printing an error message, mentioning that reading
-          input from stdin is deprecated.
-
-2006-02-06 17:18  acastro
-
-        * src/messages.F90: The write_warning and write_fatal were writing
-          an awkard "WARNING: From Node x", with no information afterwards,
-          from all the nodes.  Only node zero was really printing the
-          information.
-
-          Maybe in the future we should allow for a way for all non-head
-          nodes to write warning and fatal errors.
-
-2006-02-05 12:33  acastro
-
-        * src/: atomic.F90, hgh.F90, tm.F90: Not really a bug fix.  The
-          problem with the Gadolinium bug report ("rc_bugs/07-Atomic_Gd")
-          is deep in the "egofv" routine, and I don't quite understand it.
-          What I have done is:  - for HGH pseudopotentials, the atomic
-          wavefunctions are not strictly neccesary, so if they are not
-          found, they are just not used. "egofv" does no longer kill the
-          program, but passes back an error flag and the program emits a
-          warning. The program can no longer do LCAO, but hopefully it
-          could converge. I could not try it in the case of Gadolinium,
-          because in any case the memory needed to get all the projectors
-          is so large that it does not fit in my laptop.   - for TM
-          pseudopotentials, the wavefunctions are needed to build the
-          projectors. So if the error is produced, the program stops. But
-          the error message emitted now is more friendly than before.
-
-          In any case, the proper solution to these issues will have to be
-          done for next release.
-
-2006-02-04 20:22  acastro
-
-        * src/mesh_init.F90, testsuite/rc_bugs/08-TDELF_C2H4: Bug fixed.
-
-          This bug was the one reported in 08-TDELF_C2H4, which I remove.
-          The input of the file was not consistent any more, in any case.
-
-          The bug showed up when trying to write a dx file. There was a
-          seg-fault whent trying to pass the mesh to a cube, and I traced
-          it back to be some kind of round-off error in the point that I
-          changed in mesh_init. Probably it is a quick and dirty trick, but
-          we should leave a deeper clarification of the mesh module for
-          after the release.
-
-2006-02-04 15:18  acastro
-
-        * src/poisson.F90: Bug fixed.  Some compilers (intel) seem to have
-          problems manipulating big 3D arrays.
-
-2006-02-04 02:45  acastro
-
-        * src/out_inc.F90: Bug fixed.  Under some circumstances, this bug
-          stopped some parallel runs in marenostrum. I don't know why it
-          did not show up always.
-
-2006-02-03 19:22  acastro
-
-        * src/systm.F90: The argument parallel_mask of system_init was
-          flagged as optional.  Then the internal argument parallel_mask_
-          was set to be equal to parallel_mask when it was present, as
-          usual... except that then it was not used.  Instead of fixing
-          this, I noticed that system_init is only called once, and
-          parallel_mask was passed. So no need for an optional argument
-          there.
-
-2006-02-03 18:27  acastro
-
-        * src/run.F90: (Possible) bug fixed: The variable mode (now
-          parallel_mask), used in the routine get_mode_parallelized (now
-          renamed to get_parallel_mask), was not initialized to 0. Some
-          compilers do not initialize variables to 0, so this could cause
-          trouble.
-
-2006-02-02 19:20  acastro
-
-        * liboct_parser/: parse.c, parser_f.c: Bug fixed.  *
-          parse_block_string function (file parse.c): I think that it
-          should return an error code whatever is read is not a string. For
-          other case it is OK to convert, but not in this case.  *
-          parse_block_error (file parser_f.c): I am not sure about this
-          one.  I uncommented the exit function. I believe that the code
-          should stop if an error is encountered. But whoever commented
-          that code probably had reasons for it, so take a look, maybe I am
-          wrong.
-
-          Now the code seg-faulted if a non-string was found where a string
-          should be found.
-
-          For next release we have to improve the input error handling.
-
-2006-01-31 12:11  acastro
-
-        * libxc/gga_lb.c, testsuite/rc_bugs/05-Na2_LB94_Casida: Bug fixed.
-          Removed the 05-Na2_LB94_Casida bug.  The LB94 is still rather
-          under suspiscion, in any case.
-
-          I don't know why the bug was there, in fact, it looked that the
-          code that I removed was there for a reason, but I could not trace
-          it down because it was there since the first revision...
-
-2006-01-30 16:55  acastro
-
-        * doc/Makefile.am: Bug fixed.  The compilation of octopus depended
-          on the existence of emacs. I think this should not be the case,
-          so I changed the Makefile.am in order that if emacs is not found,
-          octopus.info is not attempted to be rebuilt.  This way the
-          compilation proceeds.
-
-2006-01-26 13:25  appel
-
-        * liboct_parser/parser_f.c: Correcting cut'n paste error that was
-          found by Francesco Sottile.
-
-2006-01-22 11:15  appel
-
-        * src/: casida.F90, run.F90: Removing unused variables.
-
-2006-01-22 11:15  appel
-
-        * share/util/: Makefile.am, display_partitions.sh,
-          oct-display_partitions: Renaming display_partitions.sh to
-          oct-display_partitions and adding it to bin_SCRIPTS.
-
-2006-01-14 07:44  acastro
-
-        * src/epot.F90: The code should stop if a magnetic field is
-          required, but the executable is the one that only has real
+2007-05-07 06:59  lorenzen
+
+        * : Inserted forgotten word in variable description.
+
+2007-05-04 16:18  lorenzen
+
+        * : Documented the DerivativesOrder variable.
+
+2007-05-04 11:03  xavier
+
+        * : * Made fftw mandatory for 2.1, because the code doesn't compile
+          without it and it is required for a decent perfomance.
+
+2007-03-23 18:35  xavier
+
+        * : * Changed the files to build a Debian package in 2.1.x, now the
+          the
+          octopus deb can be built on a clean debian etch (or ubuntu)
+          system
+          using gfortran.
+          
+          * I had to disable the parallel binary, because the mpich
+          available in
+          Debian is still compiled with g77 and there are some problems
+          compiling octopus with openmpi.
+          
+          * I moved the old debian/rules file to
+          debian/rules.other_compilers .
+
+2007-03-23 18:17  xavier
+
+        * : More 2.1.x fixes:
+          
+          * Modified the README file to point user to the wiki.
+          * A variable was defined twice when compiling with fftw2.
+
+2007-03-23 15:48  xavier
+
+        * : * Backport of the NP/NP_PART fix to 2.1.x
+
+2007-03-22 18:26  lorenzen
+
+        * : Revision of the RPM packaging infrastructure. The RPM spec file
+          now takes
+          care of building both serial and MPI executables.
+          
+          The rpm target of the main Makefile.am has been polished a bit to
+          respect local build
+          settings, so being root is not necessarily required any more.
+          
+          As soon as the 2.1 release will be done, I can take care of the
+          RPMs for 32 Bit and also 64 Bit.
+
+2007-03-12 12:35  xavier
+
+        * : * Bugfix: The declaration of an argument was missing, as
+          pointed out
+          in ticket 77. This was fixed in trunk.
+          
+          The other bug is already fixed in trunk and in the 2.1.x branch.
+          
+          This fixes #77.
+
+2007-02-25 21:27  acastro
+
+        * : Backport of the bug corrected in trunk. However, even if arpack
+          does
+          not crash, it does not produce very good numbers in 2.1.x (in
+          trunk,
+          however, it seems to work much better...)
+
+2007-02-07 15:12  lorenzen
+
+        * : This is a backport of revisions r2647 and r2659 to
+          branches/2.1.x.
+          Those changes renamed the following macros of global.h:
+          
+          DOUBLE -> REAL_DOUBLE
+          SINGLE -> REAL_SINGLE
+          PRECISION -> REAL_PRECISION
+          
+          Again, the rationale was that -- unfortunately -- DOUBLE
+          PRECISION is still
+          a Fortran 90 reserved word and it is a bad idea to shadow any of
+          those by
+          a macro. This caused a compilation error with the mpif.h header
+          file. With
+          this commit I also revert the last change of Xavier in the 2.1.x
+          branch, which
+          circumvented the problem by undefining the macros but became
+          superfluous by
+          this more systematic renaming.
+
+2007-02-06 19:06  xavier
+
+        * : * Compilation fix: DOUBLE and PRECISION have to be undefined
+          when
+          including mpif.h.
+
+2007-01-19 13:21  xavier
+
+        * : Some fixes before 2.1.0rc2 release:
+          
+          * Fixed address of the pseudopotential generator in doc of the
+          species
+          block.
+          * The file variables.local wasn't being added to the tarball.
+          * Two tests used old variable names for pseudopotential species.
+
+2006-12-13 06:48  acastro
+
+        * : Backport of trunk bugfix 2623, to 2.1.x.
+
+2006-12-09 12:18  acastro
+
+        * : 2.1.x now also compiles if FFTW was not found at configure
+          time.
+
+2006-11-03 15:25  xavier
+
+        * : * Backport of the LCAO fixes.
+
+2006-10-27 18:23  acastro
+
+        * : Backport of some bugs found in branch but also present in 2.1.x
+
+2006-10-06 09:52  xavier
+
+        * : Backport of alberto's bugfixes (changesets 2454 and 2403).
+
+2006-10-06 09:15  athimm
+
+        * : Missing netcdf detection fragement.
+
+2006-10-06 09:08  athimm
+
+        * : Remove the gui from 2.1.x.
+          
+          There are changes required that should change the variables'
+          interface
+          in octopus. Furthermore 2.1.x is release-ready other than the
+          gui.
+
+2006-10-06 09:06  athimm
+
+        * : Backports the netcdf detection fixes from trunk, fixes #39.
+
+2006-10-02 20:33  xavier
+
+        * : This error check can be made simpler.
+
+2006-10-02 16:37  xavier
+
+        * : This is the bug that appeared during the Benasque school. An
+          error
+          condition was not checked.
+
+2006-10-02 16:02  xavier
+
+        * : A newline at the end of this file was missing and this caused
+          problems
+          with autoconf.
+
+2006-09-13 13:58  acastro
+
+        * : [Porting one bug already fixed in trunk]
+          
+          Bug fixed.
+          
+          The Portland compiler did not like very long lines even if they
+          are
+          just comments, and did not like to mix, in an interface block,
+          the
+          function or subroutine interface definitions, with the module
+          procedure statements. I have looked up the standard, and I
+          believe
+          both things are legal, but in any case this way that compiler is
+          happy
+          and it does not harm the others compilers.
+
+2006-08-24 20:25  appel
+
+        * : A few more places where check_inp was still missing.
+
+2006-08-24 15:07  acastro
+
+        * : Bug fixed.
+          
+          The problem with the 11-sic.test (never converging) was the use
+          of
+          density mixing, instead of potential mixing. The potential mixing
+          is
+          necessary when using orbital dependent xc functionals.
+
+2006-08-24 14:17  athimm
+
+        * : Default to not use python.
+          
+          It is currently of little value and only adds to the release
+          process
+          (like forcing the release manager to perform gettext/varinfo.xml
+          steps).
+
+2006-08-24 14:14  athimm
+
+        * : Make branch point to the next release (candiate).
+
+2006-08-23 20:39  appel
+
+        * : Creating branch for 2.1.x development series.
+
+2006-08-23 20:36  appel
+
+        * : Preparing the first release candidate of octopus 2.1.0. Setting
+          version strings to 2.1.0rc1.
+
+2006-08-23 09:39  appel
+
+        * : Make the various output options public, so that they can be
+          used in other parts of the code for calls to X(output_function).
+
+2006-08-23 09:34  appel
+
+        * : This push_sub had the wrong routine name.
+
+2006-08-23 09:18  appel
+
+        * : When using UserDefinedStates as initial states for a time
+          propagation, octopus was always trying to read ground state
+          files from the tmp directory, even when all initial orbitals
+          were given as formula strings (I didn't think of this case,
+          when I was initially adding the UserDefinedStates feature).
+          Adding therefore a logical variable OnlyUserDefinedInitialStates
+          (with default "no"). If true, then one can use arbitrary
+          initial states for a time propagation (via UserDefinedStates)
+          and octopus is not attempting to read ground state orbitals.
+          
+          This is e.g. useful to propagate coherent states, or gaussian
+          wave packets. Might also be useful for excerices on time
+          propagations in the summer school.
+
+2006-08-23 08:58  appel
+
+        * : Avoid division by zero, when scalar meshes with "zero"
+          points are created.
+
+2006-08-23 08:56  appel
+
+        * : A !%Variable header was missing for one of the variables.
+
+2006-08-23 08:55  appel
+
+        * : A check_inp and a pop_sub were missing.
+
+2006-08-22 10:16  xavier
+
+        * : Added a new variable, LinearSolverMaxTol, that is the maximum
+          tolerance that will be applied to the Linear Solver.
+
+2006-08-18 12:28  xavier
+
+        * : I forgot to change the filename in this test.
+
+2006-08-17 13:36  xavier
+
+        * : * Reverted from allocatables to pointers, because the code was
+          not F90
+          standard.
+
+2006-08-17 12:20  xavier
+
+        * : * Iterations are counted once, even if the apply the
+          hamiltonian twice
+          per iteration.
+
+2006-08-17 12:17  xavier
+
+        * : * Added GPL header.
+
+2006-08-17 11:52  xavier
+
+        * : * Renamed the output file of dynamic polarizability to
+          'linear/alpha'.
+
+2006-08-17 11:38  xavier
+
+        * : * In the nl_operator class, the arrays were defined as
+          pointers, i
+          changed the definition to allocatables, this gives the compiler
+          more
+          room for optimization.
+          * I had to change some code that relied on pointers to this
+          arrays.
+          Instead i used a pointer to the operators.
+          
+          It would be nice if someone can review this changes, specially
+          for
+          mpi, i don't know if this code is checked by the testsuite.
+
+2006-08-17 10:17  appel
+
+        * : When adding multi-dataset lables to the input files yesterday I
+          forgot to change the directories in the *.test files that are
+          used for the matches. This fixes the failed periodic tests of
+          today.
+
+2006-08-17 09:50  acastro
+
+        * : Two *_inc.F90 files were missing from the noinst_HEADERS,
+          so that the package constructed by make dist was incomplete.
+
+2006-08-16 23:53  acastro
+
+        * : The regeneration of the info file, when typing "make dist" was
+          broken,
+          due to some repetition of node names which apparently is not
+          allowed.
+          Maybe we are going to get rid of this file anyways, but anyways
+          I fix this.
+          
+          The "make dist" still does not work, it breaks now in the python
+          directory, complaining about config.rpath missing.
+
+2006-08-16 12:57  appel
+
+        * : Add routines which take care of resizing the simulation
+          box for scattering calculations (by multiples of the asymptotic
+          unit cell). The resizing is done such that the spacing
+          of the "central region" matches in the end the spacing
+          that is used for a periodic calculation of the asymptotic
+          region.
+
+2006-08-16 09:57  appel
+
+        * : Only index 0 is available for spin unpolarized
+          calculations. This will fix the failed periodic
+          tests of today (that will arrive later).
+
+2006-08-15 21:05  appel
+
+        * : For spin-polarized calculations also output spin resolved bands
+          and DOS.
+
+2006-08-15 21:05  appel
+
+        * : Add unscaled k-vectors to the output of the Wigner-Seitz cell.
+
+2006-08-15 21:04  appel
+
+        * : Add labels for multi dataset mode.
+
+2006-08-15 21:04  appel
+
+        * : Uncomment this for the moment, since Input/OutputDir is not
+          (yet)
+          used and we would create non-necessary directories in multi-
+          dataset mode otherwise.
+
+2006-08-13 21:47  appel
+
+        * : Also include unscaled k-vectors in the output of the
+          fermi energy.
+
+2006-08-13 21:16  appel
+
+        * : The scaling of kpoints in crystal_init was causing all my
+          confusion about factors of two. Now I made my Wigner-Seitz
+          routine compatible to crystal_init.
+
+2006-08-13 18:17  appel
+
+        * : For speed reasons Intel 9.1 is now also the default
+          compiler for the i386 deb.
+
+2006-08-13 10:10  appel
+
+        * : When using a large number of states the record length was
+          exceeded during output. Revert again to direct io.
+
+2006-08-13 10:08  appel
+
+        * : Reciprocal cell sizes were still not correct.
+
+2006-08-12 20:24  appel
+
+    &nb