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• 3b9a9dab9c vectorize loop over frequencies in spaghettis Jonathan Karp 2021-10-13 17:37:33 -0400
• baec3b2f31 vectorize loop over frequency in dos functions and add tests Jonathan Karp 2021-10-13 14:09:48 -0400
• 3fd1295b91 fix package information in doc installation and some broken links Alexander Hampel 2021-09-30 12:17:50 -0400
• da260535d2 fix package information in doc installation and some broken links Alexander Hampel 2021-09-30 12:17:50 -0400
• c0242118b0
  Merge pull request #180 from phibeck/w90 Alexander Hampel 2021-09-29 10:00:49 -0400
• 2d6f66cbb8 Update Documentation of W90 Converter phibeck 2021-09-17 15:51:15 -0400
• 17ac9209e3 Bugfix if using bloch_basis = True and multiple inequivalent shells phibeck 2021-06-17 11:15:42 -0400
• ec1b336f75
  Update AUTHORS.txt Alexander Hampel 2021-09-24 15:55:33 -0400
• 03a85c94fa bump version up to 3.1 from app4triqs Alexander Hampel 2021-09-17 15:55:46 -0400
• 772120979a add logos for Flatiron and Simons Foundation Alexander Hampel 2021-09-17 15:53:45 -0400
• 4064207dd0 [cmake] Require triqs3.1+ in debian package dependencies Nils Wentzell 2021-09-17 15:33:19 -0400
• 35fc17f807 [cmake] Bump required TRIQS Version to 3.1 Nils Wentzell 2021-09-17 15:27:58 -0400
• 0725799054 [cmake] Bump app4triqs version number to 3.1.0 Nils Wentzell 2021-09-17 15:27:42 -0400
• 29c7c337b1 merge latest app4trqs skeleton changes Alexander Hampel 2021-09-17 14:24:22 -0400
• b924f85fde Bugfixes in blockstructure.py for the case of #corr_shells != #ineq_shells hschnait 2021-08-30 14:14:11 +0200
• e45001652f
  Merge pull request #176 from hschnait/3.0.x Alexander Hampel 2021-08-31 07:55:59 +0200
• 2d3dcb3398 Bugfixes in blockstructure.py for the case of #corr_shells != #ineq_shells hschnait 2021-08-30 14:14:11 +0200
• e2332d4de6 [doc] Make sure to install ttf, woff2 and eot files Nils Wentzell 2021-08-18 16:45:33 -0400
• 17eee7a13d final version of the new rtd design update Alexander Hampel 2021-08-18 16:00:28 -0400
• a06301304f change to read the docs sphinx theme Alexander Hampel 2021-08-02 13:43:07 -0400
• f66848f303 fix Vasp INCAR for NiO example Alexander Hampel 2021-08-16 12:58:22 -0400
• a1b5421864 fix for python binary, c order for arrays, and NiO tutorial Alexander Hampel 2021-08-16 12:51:55 -0400
• d5401cb4c0
  Merge pull request #173 from thenoursehorse/plovasp-kweight-fix Alexander Hampel 2021-06-23 08:33:01 -0400
• 75a7749180 fixed normalization of kwghts to allow symmetries - very tunnel visioned and haven't checked anything else H. L. Nourse 2021-06-22 14:44:17 +1000
• 4a74b446a2 [jenkins] set OMP_NUM_THREADS Dylan Simon 2021-06-15 10:13:55 -0400
• 84d45485f9 [ghactions] Install libomp in Ubuntu setup Nils Wentzell 2021-06-11 09:25:32 -0400
• 8bcb6f3391 Merge remote-tracking branch 'app4triqs-remote/3.0.x' into 3.0.x Nils Wentzell 2021-06-09 15:06:03 -0400
• db8a7e543e Bugfix in block_structure.py Hermann Schnait 2021-06-09 13:06:25 +0200
• 1dfe861164
  Merge pull request #171 from TRIQS/hschnait-patch-2 Alexander Hampel 2021-06-09 14:26:54 -0400
• da2eb26940
  Bugfix in block_structure.py Hermann Schnait 2021-06-09 13:06:25 +0200
• 1c6d29d6a3 [cmake] For ANALYZE_SOURCES=ON run cppcheck in c++20 mode Nils Wentzell 2021-06-07 14:20:10 -0400
• 31649d25b2 [cmake] Bump version requirement to 3.12.4 for cxx_std_20 availability Nils Wentzell 2021-06-07 14:11:19 -0400
• 755381be4b Merge remote-tracking branch 'app4triqs-remote/unstable' into unstable Nils Wentzell 2021-06-03 15:03:37 -0400
• 7a69fb1a47 [jenkins] updates for new jenkins node Dylan Simon 2021-06-03 14:39:01 -0400
• a27e231c4d [jenkins] increase build parallelism to -j4 Dylan Simon 2021-06-03 12:18:33 -0400
• 1a63d0854c [jenkins] more explicit node allocation Dylan Simon 2021-06-03 00:59:04 -0400
• ba7edf6053 Merge remote-tracking branch 'app4triqs-remote/3.0.x' into 3.0.x Nils Wentzell 2021-05-28 14:43:10 -0400
• 8cc1949be0 [jenkins] add sanitize platform build Dylan Simon 2021-05-28 13:11:47 -0400
• 89e1163f21 [cmake] Remove usage of linktime optimizations Nils Wentzell 2021-05-27 17:50:59 -0400
• 3c5196722f [jenkins] Bump osx gcc version to 11 Nils Wentzell 2021-05-27 17:48:02 -0400
• d902a04b67 [jenkins] Remove centos-gcc build Nils Wentzell 2021-05-27 17:47:28 -0400
• db0b1ab82e [jenkins] switch osx to gcc-11 Dylan Simon 2021-05-27 17:27:11 -0400
• dad5c8df94 [ghactions] Build on osx 11 (big sur) Nils Wentzell 2021-05-27 17:04:11 -0400
• 5db2431989 [ghactions] Generate VERBOSE build log on compilation failure Nils Wentzell 2021-05-27 15:31:49 -0400
• 429e625d09 [ghactions] Bump ubuntu builds to clang12 and osx builds to gcc11 Nils Wentzell 2021-05-27 15:31:16 -0400
• 33b548eb59 Switch Build_Deps default from IfNotFound to Always Nils Wentzell 2021-04-13 09:41:34 -0400
• 6a8d838b20 from_L_G_R requires a Green function with data layed out in C-order Nils Wentzell 2021-05-26 17:49:09 -0400
• b69baf140e Use nda over TRIQS_RUNTIME_ERROR in dos_tetra3d Nils Wentzell 2021-05-25 16:53:52 -0400
• 3648fd74e8 Automated porting to triqs + meshes + nda Nils Wentzell 2021-05-18 14:29:45 -0400
• 342aa363d9 fixed tests to work with dev version of triqs Alexander Hampel 2021-01-12 09:52:58 -0500
• 9b22859553 added helper function to flatten gf_struct objects for new triqs version Alexander Hampel 2021-01-12 09:52:37 -0500
• fae1217fa4 switched lapack target from triqs to nda Alexander Hampel 2021-01-12 09:51:21 -0500
• 3122ab2a83
  Updates of Wannier90Converter: (#169) Sophie Beck 2021-05-06 08:37:15 -0400
• 9970aec92f Updates of Wannier90Converter: phibeck 2021-04-23 12:52:07 -0400
• 0a71b29096
  Added parameter kpts_to_write to SumkDFT.calc_density_correction (#170) merkelm 2021-05-05 17:55:40 +0200
• 416f860126 Made docstring of calc_density_correction clearer mmerkel 2021-05-05 15:43:37 +0200
• b1dad27d56 For density correction in vasp, added option to select kpoints mmerkel 2021-05-05 10:41:47 +0200
• 4e1cdfe4e2 [jenkins] update osx python path for 3.9 Dylan Simon 2021-03-01 12:26:42 -0500
• 6fc01806d0 update SVO tutorial for dft tools 3 Jonathan Karp 2021-02-25 12:41:57 -0500
• 550199fe97
  Merge pull request #166 from jkarp314/patch-2 Alexander Hampel 2021-02-25 13:51:37 -0500
• 783dba2ae3
  update SVO tutorial for dft tools 3 Jonathan Karp 2021-02-25 12:41:57 -0500
• ad0853b6bc Revert "[jenkins] try setting ansiColor as a build property" Dylan Simon 2021-02-17 15:48:52 -0500
• 2a9b29741e [jenkins] try setting ansiColor as a build property Dylan Simon 2021-02-17 15:43:40 -0500
• ab32b3fb51 [jenkins] try adding ansiColor support Dylan Simon 2021-02-17 14:28:20 -0500
• 064a3c85f9 [jenkins] For failed compilation on OSX, follow up with a serial VERBOSE=1 build Nils Wentzell 2021-02-10 10:45:35 -0500
• 07ddcb3c40 [cmake] For Build_Documentation=ON make sure PythonSupport is enabled Nils Wentzell 2021-02-09 16:39:07 -0500
• 5ac27b8f2e
  Update guide on Vasp src changes for converter Alexander Hampel 2021-02-08 08:04:15 -0500
• 92e24a9ada
  Revision of Wannier90Converter: Alexander Hampel 2021-02-05 18:08:46 -0500
• aeaebb04ae Revision of Wannier90Converter: 1) write the Hamiltonian in Bloch space for charge self-consistent calculations, and 2) spin-orbit coupling sobeck 2020-09-15 16:36:57 +0200
• 2d7818a85f Add scipy to requirements.txt Nils Wentzell 2021-02-05 12:09:10 -0500
• 3973147669 Add numpy to requirements.txt Nils Wentzell 2021-02-05 12:06:47 -0500
• 2fdced8d63 Add mako to requirements.txt Nils Wentzell 2021-02-05 11:49:46 -0500
• 60b1a247ce [gh-actions] Specify FC env variable during build Nils Wentzell 2021-02-03 11:32:07 -0500
• 6dccb363de Merge remote-tracking branch 'app4triqs-remote/unstable' into unstable Nils Wentzell 2021-02-03 11:03:08 -0500
• d0c0bc1cde [cmake] Clean up IPO section in CMakeLists.txt Nils Wentzell 2021-02-03 11:02:56 -0500
• 57e9896b9a [cmake] Restore compatibility against cmake version 3.9.6 Nils Wentzell 2021-02-03 11:00:07 -0500
• 1baca5f156 [gh-actions] Install gfortran for OSX builds Nils Wentzell 2021-02-03 09:18:58 -0500
• 4ed788967d Remove unnecessary code in _mpi.py Hiroshi Shinaoka 2021-02-03 06:54:05 +0900
• 8c9a31528e Converters can be run in non-MPI environment Hiroshi Shinaoka 2021-02-03 06:48:43 +0900
• 16bf47b9cc [cmake] Globally disable compiler extensions, minor improvements in CMakeLists.txt Nils Wentzell 2021-02-01 15:02:57 -0500
• 73aa51608e [cmake] In extract_flags.cmake inspect INTERFACE_COMPILE_FEATURES and add -std=.. flags accordingly Nils Wentzell 2021-02-01 09:42:03 -0500
• 5031acea73 [ghactions] Be sure to apt-get update before apt-get install Nils Wentzell 2021-01-22 14:40:20 -0500
• efad2fe6ef [cmake] Use googletest master branch (live-at-head) instead of release-1.10.0 Nils Wentzell 2021-01-22 15:39:11 -0500
• f247db58d8 [cmake] Enable Linktime optimizations when available, bump cmake requirement to 3.9.6 Nils Wentzell 2021-01-22 14:53:04 -0500
• 6bd1e51c4e [cmake] Provide an alias PROJECT_NAME::module_name for each module Nils Wentzell 2021-01-22 14:49:47 -0500
• 74cf0207dc Do not warn about c++20 extensions when using clang Nils Wentzell 2021-01-22 14:49:22 -0500
• 2b28ef836c [ghactions] Be sure to apt-get update before apt-get install Nils Wentzell 2021-01-22 14:40:20 -0500
• 4d618d36da
  Merge pull request #159 from AlynJ/elkcon_bands Alexander Hampel 2021-01-20 15:36:17 -0500
• c5c2f6daed elk_bands_update Alyn James 2021-01-20 12:54:10 +0000
• c02a8585a5 triqs3 bugfix in doc Hermann Schnait 2021-01-14 10:41:10 +0100
• 5f658e93c3
  Merge pull request #158 from TRIQS/hschnait-patch-1 Alexander Hampel 2021-01-14 09:13:43 -0500
• b4040055b5
  triqs3 bugfix in doc Hermann Schnait 2021-01-14 10:41:10 +0100
• e33eec8c7e
  Merge pull request #154 from 70akaline/unstable Alexander Hampel 2020-11-27 10:37:45 -0500
• 7634752eb1
  symm_deg_gf var name update 70akaline 2020-11-26 13:07:04 +0000
• c70e1aa483
  wrong order of orbital setting and set Coulomb mat 70akaline 2020-11-26 13:02:33 +0000
• 93cf096932 changed fermi weights from np array complex to float in accordance with h5 structure Alexander Hampel 2020-11-24 16:35:27 -0500
• fc2ce66238 corrections to additional h5 structure format Alexander Hampel 2020-11-24 16:03:32 -0500
• 160dc9d9ae
  Merge pull request #152 from materialstheory/unstable Alexander Hampel 2020-10-30 17:29:52 -0400
• 4521842a07 Merge remote-tracking branch 'app4triqs-remote/unstable' into unstable Nils Wentzell 2020-10-30 16:13:51 -0400
• 1f8cf2462b [gh-actions] Install numpy scipy and mpi4py through pip3 instead of brew Nils Wentzell 2020-10-30 15:15:17 -0400