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Author SHA1 Message Date
Olivier Parcollet
c0993d9db8 mc_tools : add debug print under macro 
When TRIQS_MCTOOLS_DEBUG is defined,
the qmc now reports some basic debug info
(when is a move accepted, rejected, ...).
 2013-12-23 23:21:30 +01:00
Olivier Parcollet
5f7e0989a3 gfs. Rm code introduced only for Krylov QMC 
- This function was redondant : qmc code cleaned.
- using make_clone in gfs namespace for ADL usage.
 2013-12-23 23:21:30 +01:00
Michel Ferrero
a97a4d09b6 Fix test after conj changes 
conj(double) now returns a complex. The mapped_functions test output
had to be fixed accordingly.
 2013-12-23 13:33:12 +01:00
Michel Ferrero
15f0899016 Fix missing cached key in archives 
When an object with __hdf_write__ was written in an archive, the
corresponding key was not cached. Therefore, one could not access
the object which had just been written.
 2013-12-23 13:15:27 +01:00
Olivier Parcollet
8cc5012347 Fix #42. Conj overload issue 
std::conj returns a complex according to std.
On gcc, we need to define it (bug?) but on clang libc++
it is an error.

-> one test is still failing : to be decided later
 2013-12-21 20:07:52 +01:00
Olivier Parcollet
dce4edbdde Correction: new test det_manip_constructor 
The matrix was singular !
(-> exception on OS X).
 2013-12-21 14:30:18 +01:00
Olivier Parcollet
c185be83c0 Merge pull request #41 from lmessio/master 
Changes in the doc and one bug removed in det_manip
 2013-12-21 04:43:50 -08:00
Olivier Parcollet
05a4758676 install : update boost.rb 2013-12-21 13:25:37 +01:00
Michel Ferrero
b7d7c656ce Fix a missing mask in tail fit (imfreq) 
I applied the patch provided by Thomas.

  modified:   pytriqs/gf/local/gf_imfreq.py
 2013-12-19 11:54:44 +01:00
Michel Ferrero
80eb00046f Fix tail in from_L_R in gf_generic 
The order_max was not set properly.
 2013-12-18 23:10:24 +01:00
Laura Messio
f56a0abc09 doc: typo corrected 2013-12-18 22:47:30 +01:00
Laura Messio
67a1a7c079 doc: cookbooks from det_manip and arrays harmonized 2013-12-18 15:50:18 +01:00
Laura Messio
dbe2224caf more complete cookbook for det_manip 2013-12-18 13:30:17 +01:00
Laura Messio
477f5f4ea1 bug in a det_manip constructor (from vectors for x and y values) corrected 2013-12-18 11:21:39 +01:00
Olivier Parcollet
1a0ebea512 Fix #40 2013-12-17 21:38:11 +01:00
Olivier Parcollet
cce99383ee doc : update installation requirements 2013-12-17 20:47:50 +01:00
Olivier Parcollet
ce221dfc1c gf: add negative matsubara freqs 
- add possibility of having negative matsubara freqs
in the matsubara mesh.

- TODO :
   finish imtime complex
   adapt fourier in this case
   test
 2013-12-17 15:09:34 +01:00
Michel Ferrero
255de834a2 Fix max tail order in gf_imfreq 2013-12-16 14:34:02 +01:00
Michel Ferrero
3a2d3f4012 Fix tail in update_archive 2013-12-16 14:33:19 +01:00
Olivier Parcollet
0b166461ef Add C++14 detection and flags 
- if compiler detected, compile in c++1y mode.
- override with -Dcompiler_is_c14=ON if not detected.
- compilation in c++1y on clang 3.4 ok on OS X
 2013-12-10 11:54:31 +01:00
Olivier Parcollet
02b6cedd14 callback: move to std::chrono instead of boost 
- and rm boost::function clashing with std:function
(detected by new clang).
 2013-12-10 11:52:53 +01:00
Olivier Parcollet
72b1f081ac gf: fix test_fourier_matsubara 
remove the call to implementation routines
 2013-12-04 22:24:14 +01:00
Olivier Parcollet
fb6b47cacf cmake. group c++11 flags 
Now that boost compilation is gone, no need
of that mess.
Put same compilation flags for all code.
 2013-12-04 22:24:14 +01:00
Olivier Parcollet
f6e006c2e0 gf. Correct evaluator imfreq 
- overload for matsubara_freq, not the point.
 2013-12-04 12:11:48 +01:00
Olivier Parcollet
b251929138 Work on documentation 2013-11-20 15:17:08 +01:00
Olivier Parcollet
17ab555213 gf: fix matsubara_freq and mesh_pt 
- cleaner implementation, solve some bugs...
 2013-11-20 15:16:53 +01:00
Olivier Parcollet
9ce291d640 gf: update gf imfreq for g( om - nu) case 
DRAFT : to be tested further...

- update gf<imfreq>
- write a specific mesh for matsubara frequencies
- now the cast series is :
  mesh_pt --> matsubara_freq --> complex<double>
- matsubara_freq is just the matsubara frequency
- arithmetic of the mesh_pt casted to matsubara_freq
- arithmetic of matsubara_freq is casted to complex, except + and -,
  which are kept as matsubara_freq.
- evaluator now accept : int, mesh_pt, and matsubara_freq
  for matsubara_freq : for negative omega, use conjugation
  for omega outside windows, evaluate the tail on omega.
- as a result : g( om - nu) where om, nu are 2 meshes points,
  is the extrapolation outside the grid if necessary.
- updated tests
- added evaluation for tail.
 2013-11-18 23:41:32 +01:00
Olivier Parcollet
184274c893 gf : fix bug in mesh_pt_generator 
- in the default constructor, do not call the pointer
that may be null.
- appeared only in python (unused in c++), for new matsubara...
 2013-11-18 23:41:32 +01:00
Olivier Parcollet
0b7bfec32e Work on doc. 2013-11-18 23:41:32 +01:00
Olivier Parcollet
e703b1e2b7 port to clang 3.4 
- little narrowing details
 2013-11-18 23:41:32 +01:00
Olivier Parcollet
d7cf223994 arrays: clean cache, add traits ... 
- also add simple c14 helpers ....
 2013-11-18 23:41:32 +01:00
Olivier Parcollet
9cdc139214 arrays: add conj function for arrays/matrix and tests 
- map conj (and extend it for integers).
 2013-11-18 23:41:32 +01:00
Olivier Parcollet
fa6f991473 arrays: clean h5 code 
- c++11 cleaning, more doc.
- clean the array_stack and its doc.
 2013-11-18 23:41:32 +01:00
Olivier Parcollet
899210ff53 arrays: fix bug in ellipsis when it is of size 0 
- a(1,ellipsis()) for a an array<T,1> e.g.,
was not compiling.
- also added const_iterator for range to allow simple code :
  for (auto i : range {3,6}) ....-> i = 3,4,5 as in python
 2013-11-18 23:41:32 +01:00
Olivier Parcollet
c151e63de2 arrays : rm old array_proxy 
- useless old draft
 2013-11-18 23:41:32 +01:00
Olivier Parcollet
172ecaa29e add header helper files 2013-11-18 23:41:32 +01:00
Olivier Parcollet
f45dedb94e gf : improve error message 2013-11-18 23:41:32 +01:00
Olivier Parcollet
abc743c0a1 gf deprecated : correction 2013-11-05 11:39:50 +01:00
Olivier Parcollet
c1fa2c75de utility/mpi: forgot 2 inlines 2013-10-31 14:59:49 +01:00
Olivier Parcollet
8be0c208c2 gf.Fourier scalar_valued. Fix tail size 
- tail is 0, but must be of dimension (1,1)
 2013-10-31 14:54:43 +01:00
tayral
4c1c14b989 gf:fourier Add missing function in no_tail case 
- one only the Matsubara case.
- TODO: the real omega case : decide and implement.
- impl: remove superfluous dispatch in x_impl
 2013-10-31 14:41:48 +01:00
Olivier Parcollet
6326c2b4eb gf/clef. Bug fix, and added scalar->matrix reinterpret for blocks 
- clef : fix a little bug in storage when evaluating
  (was using the wrong trait to deduce storage type).
- gf : block :
     - added reinterpret_scalar_valued_gf_as_matrix_valued
       for block function
     - cleaned make_block_gf_view_from_vector
     - added make_block_gf_view_from_vectormake_block_gf_view_from_vector_of_cython_proxy
       and changed the cython accordingly because it requires a slightly different syntax.
     - updated tests
- gf : cleaned some template.
 2013-10-31 14:41:48 +01:00
Olivier Parcollet
2eca9d8659 clef : forgot a forward in unary operator eval 2013-10-30 13:19:58 +01:00
Olivier Parcollet
0f324df3ef gf: Fix for make_fourier in scalar_valued mode 2013-10-30 13:19:33 +01:00
Olivier Parcollet
928ef222cc [API Change] parameters: required, optional 
- now chain the required

- pdef.optional( "B", short(0), " short ")
  .optional( "C", 1u, " unsigned short ")
  .optional( "D", int(2), " int ")
  .optional( "E", 3u, " unsigned int ")
  .optional( "F", long(4), " long ")
 2013-10-26 14:34:10 +02:00
Olivier Parcollet
12cb2db2ba gf: fix auto_assign for chained calls. 
- g[k_][om_] << expression was not working.
 now  implemented like for std::vector adapter.
 2013-10-26 13:49:24 +02:00
Olivier Parcollet
579368f24b gf. Clean Fourier 
- lazy_fourier and co --> fourier
- ex fourier --> make_gf_from_fourier to make a new gf
- = fourier (g) works only iif lhs is a view, like scalar.
- updated python (commented fourier method).
 2013-10-23 18:46:55 +02:00
Olivier Parcollet
1d5ea99d4f gf block : clean 
- clean some constructor and clang format
 2013-10-23 18:08:12 +02:00
Olivier Parcollet
1b5aceb2a5 gf: Work on documentation 2013-10-22 21:29:40 +02:00
Olivier Parcollet
603e397e16 gf. Clean code, rereading for doc 
- no major change. Code cleaning + clang-format.
 2013-10-22 21:29:27 +02:00