3
0
mirror of https://github.com/triqs/dft_tools synced 2024-11-18 12:03:50 +01:00
Commit Graph

1030 Commits

Author SHA1 Message Date
Malte Schüler
4b8a284a98 efermi is now read from LOCPROJ if DOSCAR does not contain it yet (e.g., for csc calculations) 2019-11-29 10:33:13 +01:00
Malte Schüler
ce6ff62af4 fixed tests for reading e-fermi from DOSCAR. Clean up of plovasp (prints from bugfixing 2019-11-25 09:53:05 +01:00
Malte Schüler
4fdf238472 E-Fermi is read from DOSCAR not from LOCPROJ 2019-11-25 07:52:40 +01:00
Malte Schüler
6b11183f4d fixed tests for incorporating kpts 2019-11-21 21:34:37 +01:00
Nils Wentzell
09b0a68b26 [cmake] Fix cppcheck invocation, add --force to cppcheck options 2019-11-21 11:54:10 -05:00
Nils Wentzell
919639bd27 [cmake] Find libasan and libubsan only if the targets are not already defined by the parent project 2019-11-18 14:04:29 -05:00
Alexander Hampel
6cedb8aaaa Extended the documentation for the VASP interface, with more precise statements about the actual implementation. 2019-11-05 11:40:23 -05:00
Nils Wentzell
64bbc3ce48 Use python instead of bash for the replace and rename operation 2019-10-31 18:19:01 -04:00
Nils Wentzell
b7dafbd2e6 Use PROJECT_VERSION over APP4TRIQS_VERSION 2019-10-28 18:23:15 -04:00
Philipp D
c03634fd2f bug fix for Darwin replace_and_rename.sh 2019-10-24 14:34:27 -04:00
Nils Wentzell
9a3ab9327c [travis] Switch to bionic travis image, clean dependencies 2019-10-20 17:22:04 -04:00
Nils Wentzell
762435cf0b Add github issue templates for bug and feature request 2019-10-16 10:01:16 -04:00
Manuel Zingl
ef74ea30b8 Update Changelog 2019-10-15 10:06:35 -04:00
Nils Wentzell
c78b3eeab7 [doc] Add doc/cpp2rst_generated to gitignore 2019-10-11 14:54:16 -04:00
Nils Wentzell
0388421428 Add .gitignore for compile_commands.json 2019-10-10 17:29:54 -04:00
Nils Wentzell
5768a7f748 [cmake] Only use Wshadow=local for gcc 2019-10-10 15:59:39 -04:00
Nils Wentzell
9bca12d1ea [jenkins] Synchronize Jenkinsfile with app4triqs 2019-10-10 13:46:39 -04:00
Nils Wentzell
09c40e741a [cmake] Make regex in extract_flags.cmake more generic 2019-10-09 16:24:13 -04:00
Nils Wentzell
60b68690ec Add documentation to python module 2019-10-09 16:23:25 -04:00
Nils Wentzell
7859505fea [doc] Remove non-existant tag from doc example 2019-10-09 16:23:02 -04:00
Nils Wentzell
e4063bf4d0 [cmake] Prioritize -isystem over -I in extract_flags macro, Minor fix for empty list of inc_dirs 2019-09-26 09:49:34 -04:00
Nils Wentzell
a26bfae4d1 [cmake] Bump cppcheck c++ standard to c++17 2019-09-24 17:50:38 -04:00
Nils Wentzell
9f5aa8578c [cmake] Provide extract_flags macro in share/cmake directory, simplify creation of docs_cpp2rst target 2019-09-24 15:17:47 -04:00
Nils Wentzell
10fd7f19a0 Add additional arguments to c++2py module generation call 2019-09-24 14:50:54 -04:00
Nils Wentzell
5daab99fa3 [readme] Add documentation file adjustments to the getting started list 2019-09-24 09:51:32 -04:00
Nils Wentzell
cc81dffa4a [cmake] Minor corrections 2019-09-18 14:23:14 -04:00
Nils Wentzell
eefa265359 [doc] Include a markdown cheat sheet in the feature request issue template 2019-09-17 14:04:27 -04:00
Nils Wentzell
bdee25bb1b [doc] Clean issue templates and make them more concise 2019-09-17 14:00:03 -04:00
Nils Wentzell
df33cb6ffd [cmake] Clean c++/app4triqs/CMakeLists.txt after recent additions to triqs Findsanitizer.cmake 2019-09-16 14:39:27 -04:00
Malte Schüler
7a6450b6fa implemented multiple ncsf VASP cycles 2019-09-16 10:59:46 +02:00
Nils Wentzell
30f32f8dec [cmake] Update cppcheck language standard 2019-09-13 17:51:16 -04:00
Nils Wentzell
24f5268394 Minor clang-tidy fix in app4triqs.hpp 2019-09-13 17:10:35 -04:00
Nils Wentzell
d48811bf13 [clang-tidy] Disable modernize-use-trailing-return-type 2019-09-13 17:09:53 -04:00
Nils Wentzell
31433b69fb [cmake] Build gtest from test/c++/gtest and use gtest_main target 2019-09-06 16:52:59 -04:00
Nils Wentzell
da55635d5c Include gtest as a git subtree in test/c++/gtest 2019-09-06 16:12:18 -04:00
Nils Wentzell
f5b936317d Squashed 'test/c++/gtest/' content from commit 3f05f651
git-subtree-dir: test/c++/gtest
git-subtree-split: 3f05f651ae3621db58468153e32016bc1397800b
2019-09-06 16:12:03 -04:00
Nils Wentzell
7ab1e6af22 Add C to Project Languages 2019-09-06 15:27:55 -04:00
Nils Wentzell
a69a449a43 Move setup files into separate bash scripts and adjust README
* Treat Linux and Darwin differently
2019-09-05 16:30:29 -04:00
Nils Wentzell
bdf91fa925 [app4triqs] Include cpp2rst_generated/contents in toctree 2019-09-04 17:37:50 -04:00
Nils Wentzell
28d600f149 [app4triqs] Rename files and Python module from toto to app4triqs
-Automatically detect any wrap generator files
-rename tests to basic/Py_Basic
2019-09-04 17:37:50 -04:00
Nils Wentzell
445e15d153 [app4triqs] Improved README 2019-09-04 17:37:42 -04:00
Nils Wentzell
5cb8bbf042 [cmake] Add -Wno-gcc-compat to project_warnings target 2019-09-04 16:17:51 -04:00
Nils Wentzell
36a21ee819 [jenkins] Change permissions for application sources in Dockerfile 2019-08-28 11:20:16 -04:00
Dylan Simon
058e39a6c2 [jenkins] Put a mutex around packaging repo updates
"correct" fix for race failures, though could use separate labeled
resources for each repo
2019-08-27 17:37:02 -04:00
Nils Wentzell
5148de2c29 Disable gcc in travis builds due to ld problem on xenial 2019-08-27 15:54:56 -04:00
Nils Wentzell
f28f0e68a4 [doc] Add cpp2rst and example output generation to doc building 2019-08-27 15:43:37 -04:00
Nils Wentzell
66f270e741 App4triqs changelog 2019-08-27 15:42:39 -04:00
Nils Wentzell
3c94a87ca6 Update README file with more detailed instructions 2019-08-27 15:39:03 -04:00
Manuel
2d491050cc [doc] Make doc around .indmftpr clear (issue #122) 2019-08-26 13:19:14 -04:00
Dylan Simon
180d062846 [jenkins] Don't trigger PR builds on upstream changes 2019-08-20 16:01:55 -04:00