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19,456 Commits 5 Branches 40 Tags 1.8 GiB
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28 Commits

Author SHA1 Message Date
fabrizio22 9b5d6aff7e XClib test compilation fixes 2021-01-20 13:36:43 +01:00
fabrizio22 79a4dd80bf XClib - libxc initialization 2021-01-14 16:01:58 +01:00
Paolo Giannozzi 0fd2814f94 Small change: remove unneeded dependencies upon QE modules 2021-01-06 16:06:22 +01:00
fabrizio22 6d3da3964e XClib - small compilation fixes 2021-01-06 16:06:22 +01:00
fabrizio22 ccccf39ecb XClib - xclib_test active 2021-01-06 16:06:22 +01:00
fabrizio22 689c034014 XClib - compilation fixes 2021-01-06 16:06:22 +01:00
Paolo Giannozzi c7fbd7ecbc BEEF merged into QE, courtesy Johannes Voss 2021-01-06 16:06:22 +01:00
fabrizio22 55f6d62f4c XClib - a few fixes (including b3lyp) 2021-01-06 15:42:52 +01:00
fabrizio22 2199fa4b1e XClib - comb. of qe and libxc dft in dgcxc 2021-01-06 15:42:52 +01:00
fabrizio22 cf81c2d9c7 XClib - test moved from PP to XClib 2021-01-06 15:42:52 +01:00
fabrizio22 509ce8ad64 XClib - all in module xc_lib 2021-01-06 15:42:52 +01:00
fabrizio22 8da3d663e1 XClib - funct into XClib (except vdw) 2021-01-06 15:36:00 +01:00
fabrizio22 bb3e2eb31b XClib - all external calls removed 2021-01-06 15:36:00 +01:00
fabrizio22 f81ccfe2a5 XClib - some reorganization 2021-01-06 15:36:00 +01:00
fabrizio22 901de19d0f XClib - dgcxc wrapper 2021-01-06 15:36:00 +01:00
fabrizio22 2a27424530 XClib - dmxc wrapper 2021-01-06 15:36:00 +01:00
fabrizio22 90663b7bf9 XClib - mgga wrapper 2021-01-06 15:36:00 +01:00
fabrizio22 0336b35bc3 XClib - gga wrapper 2021-01-06 15:36:00 +01:00
fabrizio22 656d4c56ef XClib - lda wrappers scratch 2021-01-06 15:36:00 +01:00
fabrizio22 c1337867b2 XClib - lib name changed 2021-01-06 15:36:00 +01:00
fabrizio22 06468bfdb1 XClib - beef aligned 2021-01-06 15:36:00 +01:00
fabrizio22 3d88b6cc02 XClib - mgga - scratch 2021-01-06 15:35:59 +01:00
fabrizio22 e2e0db9c2d XClib - d_gga - unpol 2021-01-06 15:35:59 +01:00
fabrizio22 7621a4805d XClib - d_lda - unpol - fix2 and alignment 2021-01-06 15:35:59 +01:00
fabrizio22 694b37a53e XClib - gga unpol - scratch 2021-01-06 15:31:24 +01:00
fabrizio22 2566c6fcf9 XClib-lsda-scratch 2021-01-06 15:31:24 +01:00
fabrizio22 20e786e37e XClib - LDA - functionals in modules for gpu split 2021-01-06 15:31:24 +01:00
fabrizio22 2f933d101e XClib - lda - scratch 2021-01-06 15:31:24 +01:00