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File libxc.changes of Package libxc
------------------------------------------------------------------- Tue Jan 1 10:19:28 UTC 2019 - Jan Engelhardt <jengelh@inai.de> - Trim time-sensitive wording from description. ------------------------------------------------------------------- Sun Dec 30 17:53:58 UTC 2018 - Christoph Junghans <junghans@votca.org> - Update to 4.2.3 * timeout when generating the xc_func.h file with CMake. - Major spec file cleanup ------------------------------------------------------------------- Sun Jun 17 07:21:21 UTC 2018 - rwarmbier@uj.ac.za - Update to 4.2.1 * Many changes (see http://www.tddft.org/programs/libxc/changes/) , f.e.: * License from LGPL to the Mozilla Public License 2 (MPL2). * CPP for Fortran sources macro, so that cpp -C -freestanding is used instead of cpp -ansi. ------------------------------------------------------------------- Wed Mar 14 17:36:43 UTC 2018 - robert.warmbier@wits.ac.za - Update to 4.0.4 * Fixed: * Incorrect XC_CORRELATION flag in the XC_LDA_K_ZLP, XC_LDA_X_RAE, and XC_GGA_XC_HLE16 functionals. * Incorrect XC_EXCHANGE flag in the XC_GGA_C_SG4, XC_GGA_C_PBE_MOL, and XC_GGA_C_TM_PBE functionals. * Incorrect XC_EXCHANGE_CORRELATION flag in the XC_MGGA_C_SCAN_RVV10 functional. * Incorrect XC_FAMILY_MGGA family in the HYB_MGGA_XC_B0KCIS functional. ------------------------------------------------------------------- Wed Nov 22 07:23:57 UTC 2017 - robert.warmbier@wits.ac.za - Update to 4.0.3 * Fixed: Generation of libxc_docs.txt file. * Added: Missing C to Fortran interface for xc_f90_nlc_coef. ------------------------------------------------------------------- Wed Nov 8 09:29:16 UTC 2017 - robert.warmbier@wits.ac.za - Update to 4.0.2 * See https://gitlab.com/libxc/libxc/wikis/Libxc-changes for details * There are a few incompatible changes, be careful ------------------------------------------------------------------- Tue Nov 7 15:44:41 UTC 2017 - robert.warmbier@wits.ac.za - Update to 3.0.0 * See https://gitlab.com/libxc/libxc/wikis/Libxc-changes for details * Added * Micro version number to version function and version header file. * Version_string function, which returns the version number in the following format: major.minor.micro *Fortran 2003 interface using the iso_c_bindings module. ------------------------------------------------------------------- Thu Jul 21 08:02:24 UTC 2016 - robert.warmbier@wits.ac.za - Update to 2.2.3 * Fixed bugs in the following functionals: * GGA: X_N12, C_N12, C_N12_SX, all the X_HJS_*, X_VMT84_GE * HYB_GGA: X_N12_SX, all the XC_HJS_*, XC_O3LYP, XC_X3LYP * GGA (second order derivatives only): X_B88, X_OPTB88_VDW, X_MB88, K_LLP, K_FR_B88, K_THAKKAR * Fixed build with gcc 6. ------------------------------------------------------------------- Tue Nov 24 13:07:36 UTC 2015 - robert.warmbier@wits.ac.za - First submit using 2.2.2
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