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Author SHA1 Message Date
Olivier Parcollet
ccc17bbb4e h5 serialization 
- add an h5 serialization using hdf5 >= 1.8.9
  and a file in memory.
- following doc.
 2014-05-20 22:24:30 +02:00
Olivier Parcollet
8c0bf592d0 Fix compilation of py_converter. 
- py_converters in hpp files
- add guard to prevent inclusion in the wrapper (to avoid 2
  specialisation of the same py_converter).
 2014-05-20 22:24:30 +02:00
Michel Ferrero
068c4a116d Fix a bug in simple_read_write.hpp 2014-05-20 18:08:28 +02:00
Olivier Parcollet
dd91c51647 wrapper. 
Correction converter specialization
(avoid redeclaration).
 2014-05-19 22:18:17 +02:00
Olivier Parcollet
914901864a wrapper. Correction 
- clean the call to py_converter.
- add a & in the generic function py2c (to be specialized later).
 2014-05-19 21:58:33 +02:00
Olivier Parcollet
af084f5d59 parameters & wrapper 
- new parameter class :
  parameters are viewed as form, built in C++, and filled in C++/python.
  Each field of the form as a precise C++ type (erased using standard techniques).
  First tests ok, to be reread/checked.

  TODO : serialization is commented. Lead to long compilation time & large code
  due to boost::serialization. Use h5 when possible.

- wrapper :
  - separated the converters of the wrapped type in the TRIQS library
  - necessary for parameters (it used outside an .so) and potentially
    other codes, outside an .so module
 2014-05-19 15:19:18 +02:00
Olivier Parcollet
a9bcc33c7e minor correction for linux 
- vector on C++14 has explicit default (until C++14 apparently)
  it is a small difference between libc++ and gnu libstdC++
 2014-05-11 21:57:18 +02:00
Olivier Parcollet
e32602180c Cleaning h5 interface 2014-05-11 21:47:52 +02:00
Olivier Parcollet
3a31077d51 gf : new wrapper 2014-05-11 21:47:52 +02:00
Olivier Parcollet
3a9f986461 gf: add a few functions in C++ 2014-05-11 21:47:52 +02:00
Olivier Parcollet
376056f7bd gf : add indices, name in C++ 2014-05-11 21:47:51 +02:00
Olivier Parcollet
5105e04ac7 Add new wrapper generator 
- with pytriqs.wrap_test as an example.
 2014-05-11 21:47:46 +02:00
tayral
2be9587078 Small fix in gf doc. 2014-05-08 12:29:39 +02:00
tayral
3aa380ba9d Fixed abs bug in bravais_lattice + added method 
When constructing the last unit vector in 2D, the sanity check was wrong because of usage of abs instead of std::abs.

Added method energy_on_bz_path_2 that returns the energy *matrix* at each k point on a given path instead of the eigenvalues of this matrix. The name of the function should be changed (to energy_matrix_on_bz_path?)

Renaming energies_on_bz_path_2 to energy_matrix_on_bz_path
 2014-05-08 12:09:58 +01:00
tayral
7752db89c2 Added linear_to_index to matsub_freq 2014-05-08 12:04:54 +01:00
tayral
91dc34a869 Added accessor positive only to MeshImFreq 2014-05-08 12:04:54 +01:00
Olivier Parcollet
78cbbaa52f Fix #74. Correction of previous commit for gcc 4.8.1 
- an include was missing after reorganisation.
 2014-05-05 18:29:52 +02:00
Olivier Parcollet
8c725f8d5e Work on compilation speed. 
- h5/make_h5.... only used in parameters.
- old boost includes before C++11
- remove boost serialization, make macro TRIQS_MAKE_NVP temporarely
- remove boost::is_complex (can be written in 2 lines...)
- move some lib in cpp
 2014-05-02 20:49:19 +02:00
Olivier Parcollet
5172f342be correct include in ising2d test. 
triqs include goes FIRST.
(for C++14 mode in clang, e.g.).
 2014-04-25 16:07:32 +02:00
Olivier Parcollet
09bf713dc8 clef: correct TRIQS_CLEF_IMPLEMENT_LAZY_METHOD 
- The name of the object was left to the name used in the test/debug.
 2014-04-25 16:06:44 +02:00
Olivier Parcollet
384c05188c exceptions handling : slight improve 
- separate the stack trace from the error message for better python
  handling
- separate triqs::excption from triqs::runtime_error
 2014-04-23 19:57:56 +02:00
Hartmut Hafermann
a0bfead2c6 added a missing dependency for compiling doc 2014-04-22 11:45:09 +02:00
Olivier Parcollet
b1508a07ff statistics : fix get_value_type detection 
- clean a bit the auto_correlation_time
 2014-04-17 13:48:54 +02:00
tayral
2c6da6a35a Made autocorrtime calculation from binning faster. 
Bin size is doubled at each step to converge faster and reuse previous binned series.
 2014-04-17 13:39:51 +02:00
tayral
0e23db7f92 Added constructor of observable on binned_series 2014-04-17 13:39:51 +02:00
tayral
14067abb34 Statistical tools documentation. 2014-04-17 13:39:51 +02:00
tayral
572053f40d Added ising2d test for statistics. 2014-04-17 13:39:50 +02:00
Olivier Parcollet
a730f093d6 arrays: fix fold and update documentation 
- fold was not correct in e.g. passing an int as init instead of a
  double (was leading to narrowing in return).
- better return type deduction.
- there was an error in the doc (order of argument in the lambda !)
- add a more complex example (Frobenius norm of matrices).
 2014-04-09 21:24:03 +02:00
Olivier Parcollet
db59c8e5fc correction: previous commit, forgot a namespace 
- in some case, need to add triqs::clef in the macros.
(was not compiling doc).
 2014-04-09 12:12:41 +02:00
Olivier Parcollet
2f2104e86e clef : correction of TRIQS_CLEF_IMPLEMENT_LAZY_METHOD for clang 3.3 
- there was a compilation pb with clang 3.3
- replace the decltype (with this !) by an explicit type
 2014-04-09 11:49:42 +02:00
Olivier Parcollet
4ae4dfd42b arrays: add lazy call to matrix_tensor_proxy 
- correction to previous patch
 2014-04-07 15:12:34 +02:00
Olivier Parcollet
e1e9ee20fd gf: correct auto_assign 
- g(om_)(i_,j_) was not working.
- add the triqs_clef_auto_assign function for matrix_proxy.
- simplified a bit the triqs_clef_auto_assign for gf.
 2014-04-07 13:21:36 +02:00
Olivier Parcollet
2fdba13bc5 clef: add version c14 
- a slightly different version for c++14,
to avoid some decltype and have clearer error messages.
only in c++1y mode.
 2014-04-06 22:26:22 +02:00
Olivier Parcollet
3fd3f38446 clef: fix lazy method call for gcc 
- was not compiling on gcc (forward declaration issue).
- now clearer
- add a trivial print change in the mc class (to avoid trivial commit).
 2014-04-06 13:01:17 +02:00
Olivier Parcollet
efb00ea5d3 clef: first version of generic sum function 
- to improve with in the case where function return an expression
  template, not a regular type, with a make_regular function
 2014-04-04 17:47:21 +02:00
Olivier Parcollet
9762b95936 Correction to previous commit 2014-04-04 12:03:06 +02:00
Olivier Parcollet
6fc131cd5d add nfft detection 2014-04-04 11:51:08 +02:00
Olivier Parcollet
edca014785 rng : preview 2014-04-02 20:36:54 +02:00
Olivier Parcollet
22ef7ac015 gf. add __call__(double) to gf_imtime, wrapped from C++ evaluator 2014-04-02 11:15:24 +02:00
Michel Ferrero
ecbcc60930 Add documentation for web profiling 2014-04-01 17:09:38 +02:00
Michel Ferrero
82e3b3f02b Fix a bug in bosonic Fourier transform 
Appears for full_bins and bosonic GFs.
 2014-04-01 17:09:04 +02:00
Olivier Parcollet
5267798b48 arrays: a forgotten std::forward in lazy evaluations... 
A(i_,0) was not compiling due to a missing forward ...
 2014-03-28 17:20:16 +01:00
Olivier Parcollet
9c979ceb0b Fix #66: when mc_sign_type is complex 
- for complex type sign, we do not do the previous check
(to be improved), since isinf, signbit are not defined for
complex numbers.
 2014-03-28 15:38:40 +01:00
Olivier Parcollet
c996c3ff7d mc_tools : improve treatment of infinite mc ratios 
- when the ratio returned by an attempt of a move is infinite,
previous code was just throwing TRIQS_RUNTIME_ERROR.

- Now when the ratio is infinite, it is replaced by a large number
  (>1 is enough for metropolis), and the sign is properly updated
  using std::signbit.

- NB :

- a double/float in C++ can be :  normal/ zero/ nan/ infinite / subnormal.
  Here, the code will recover only from infinite case.

- std::signbit works for infinite (according to standard).
 2014-03-27 20:33:35 +01:00
Olivier Parcollet
8045598534 Attempt to fix gelss call in fit_tail. 
uncommenting the resize fix the issue on linux.
valgrind reports no error any more.
What was the problem ?
 2014-03-19 14:01:26 +01:00
tayral
d85cf0b4d2 Working on doc for det_manip 
Work on det_manip doc
 2014-03-19 14:00:53 +01:00
tayral
558df98786 Split cpp from hpp (fit_tail) 2014-03-19 14:00:53 +01:00
Olivier Parcollet
377a0026ad add c14 less, greater 2014-03-16 00:11:56 +01:00
Michel Ferrero
5805c7c3aa Fix in off-diagonal elements of density() 
This should fix the bug noticed by Leonid in off-diagonal
elements of the density matrix.

  modified:   triqs/gfs/local/functions.cpp
 2014-03-08 13:46:31 +01:00
Olivier Parcollet
2f2044e74b gf : imfreq : clean evaluator on int 
- evaluator on int was not using the same algorithm
as matsubara_freq, which can be surprising...
 2014-03-04 22:11:36 +01:00