Updated: memory.x no longer existing

git-svn-id: http://qeforge.qe-forge.org/svn/q-e/trunk/espresso@3354 c92efa57-630b-4861-b058-cf58834340f0

Makefile

@@ -185,7 +185,7 @@ links : bindir
 	      ../PP/efg.x ../PP/plotband.x ../PP/plotrho.x ../PP/pmw.x \
 	      ../PP/pp.x ../PP/projwfc.x ../PP/pw2casino.x ../PP/pw2wan.x \
 	      ../PP/voronoy.x ../PP/pw_export.x \
-	    ../PW/memory.x ../PW/pw.x \
+	    ../PW/pw.x \
 	    ../PWCOND/pwcond.x \
 	    ../atomic/ld1.x \
 	    ../pwtools/band_plot.x ../pwtools/dist.x ../pwtools/dynmat.x \

README.install

@@ -253,8 +253,7 @@ programs (with "make all"), or only some specific programs.
 "make" with no arguments yields a list of valid compilation targets.
 Here is a list:
 
-  make pw           compile PW/pw.x (electronic and ionic optimization), 
-                      PW/memory.x (checks memory usage and tests input)
+  make pw           compile PW/pw.x (electronic and ionic optimization)
   make cp           compile CPV/cp.x (Car-Parrinello MD with ultrasoft
                       pseudopotentials)
   make ph           compile PH/ph.x (phonons)

TODO

@@ -1,19 +1,19 @@
-TODO LIST - May 2006
+TODO LIST - August 2006
 
 BUGS TO EXAMINE
 
 - Zr pp buggy?
 - strange empty states with C blyp ?
 - O pseudopotentials?
+- Wannier with nonorthogonal axis?
 
 INSTALLATION/PORTING
 
-- replacement for FFTW on Intel/AMD
+- workaround for /usr/bin/oslevel problem in AIX
 
 COMMON
 
-- cleanup of the scratch directory mess: 
-  outdir, tmp_dir, wfc_dir, scradir...
+- uniform and clear values for constants in Modules/constants.f90
 
 - pseudopotentials: support new format (XML) if/when ready
 
@@ -28,6 +28,9 @@ COMMON
 - merge spherical harmonics between CP-PW and FPMD
   merge integration routines, random number generators
 
+- spherical bessel functions: only one function calculating dj_l/dx
+  j_l with l=-1 should not be needed
+
 - error is in flib/ but requires modules: not a good solution,
   things in flib/ should not use modules except maybe kinds 
   and other very low level modules 
@@ -39,12 +42,12 @@ COMMON
 
 PW
 
+- do not overwrite the charge density in a non scf calculation
+
 - add possibility to read atomic positions from file
 
 - Use more standard choices for crystal axis
 
-- fix problem with j'_l(x)Y_lm(x) for x -> 0 and l=1
-
 - make hpsi/spsi/newd/addusdens/CG/DIIS  faster
   - remove complex factor i**l from beta fct and q(r) (preliminary)
   - shift structure factor from beta to psi when computing becp (reduce memory)
@@ -63,6 +66,7 @@ PW
   and also what are exactly the output quantites!
 
 - some symmetry-related routines such as sgama are too complex
+  Verify that a group is a group (call multable again in sgama)
 
 Low priority:
 
@@ -80,8 +84,17 @@ POSTPROCESSING
   As a consequence most postprocessing codes will not work.
   The file format should be reconsidered: XML ?
 
+- chdens in parallel execution
+
+- dipolo + Makov-Payne: verify
+
+- pwtools: add example of a plot of phonon dispersions
+  Fix fqha.f90
+
 PH, D3, Gamma
 
+- stop with 'prefix.EXIT' and restart 
+
 - use charge mixing instead of potential mixing
 
 - move all phonon-specific stuff (symmetry etc) from pw into phonon
@@ -97,28 +110,25 @@ PH, D3, Gamma
 
 DOCUMENTATION
 
+- move to wiki-based documentation
+
 - better documentation for file format
 
 - single source (xml?) for text file, GUI help file, user guide
   (Tone?)
 
-- tests/examples for some features (e.g. variable cell, many kinds
-  of postprocessings) are still missing
-
 - better automated testing procedure, quick and distinct from examples!
 
 - add some benchmarks
 
-- expand and update the manual; add a list of FAQ, or of already
-  answered questions
-
-- complete the developer's (technical) guide
-
 CP/FPMD:
 
-- CP: check on small box size
+- PWGui for CP/FPMD?
 
-- Documentation needs serious improvements
+- riduce usage of nonscalable static and dynamical memroy:
+  qfunc, qrad, uspp, etc
+
+- check on small box size
 
 - Proposals from Princeton:
   * just one name for CP and FPMD