quantum-espresso/test-suite/pw_lda+U
Flaviano José dos Santos 725afd9579 Updating test-suite for compatibility with new Fermi energy protocol 2021-02-04 20:48:02 +01:00
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benchmark.out.git.inp=lda+U+V-user_ns.in Updating test-suite for compatibility with new Fermi energy protocol 2021-02-04 20:48:02 +01:00
benchmark.out.git.inp=lda+U+V_background.in 1. Debugging of the DFT+U implementation with "background" 2020-04-24 17:45:01 +02:00
benchmark.out.git.inp=lda+U+V_force_stress_ortho.in 1) DFT+U+V: moved sc_size to Modules/parameters.f90. 2020-07-08 19:05:00 +00:00
benchmark.out.git.inp=lda+U-noU.in Reference to SVN in the names of test-suite benchmark files and in the 2018-07-18 15:15:46 +02:00
benchmark.out.git.inp=lda+U-user_ns.in Reference to SVN in the names of test-suite benchmark files and in the 2018-07-18 15:15:46 +02:00
benchmark.out.git.inp=lda+U.in Reference to SVN in the names of test-suite benchmark files and in the 2018-07-18 15:15:46 +02:00
benchmark.out.git.inp=lda+U_background_one_channel.in Another test slightly updated for the same reason: avoid bogus errors 2020-04-27 16:51:28 +02:00
benchmark.out.git.inp=lda+U_background_two_channels.in 1. Debugging of the DFT+U implementation with "background" 2020-04-24 17:45:01 +02:00
benchmark.out.git.inp=lda+U_force.in Reference to SVN in the names of test-suite benchmark files and in the 2018-07-18 15:15:46 +02:00
benchmark.out.git.inp=lda+U_force_stress_ortho.in 1) DFT+U+V: moved sc_size to Modules/parameters.f90. 2020-07-08 19:05:00 +00:00
benchmark.out.git.inp=lda+U_gamma.in Reference to SVN in the names of test-suite benchmark files and in the 2018-07-18 15:15:46 +02:00
benchmark.out.git.inp=lda+U_kind1_collin.in Added two test to the test-suite: 2020-04-21 15:46:13 +02:00
benchmark.out.git.inp=lda+U_kind1_noncollin.in Added two test to the test-suite: 2020-04-21 15:46:13 +02:00
benchmark.out.git.inp=lda+U_pseudo.in Reference to SVN in the names of test-suite benchmark files and in the 2018-07-18 15:15:46 +02:00
lda+U+V-user_ns.in Added a test for DFT+U+V with starting_ns_eigenvalue (request from Ye Luo) 2020-10-07 10:34:05 +02:00
lda+U+V_background.in 1. Debugging of the DFT+U implementation with "background" 2020-04-24 17:45:01 +02:00
lda+U+V_force_stress_ortho.in 1) DFT+U+V: moved sc_size to Modules/parameters.f90. 2020-07-08 19:05:00 +00:00
lda+U-noU.in Initial commit test-suite based on TESTCODE, v0.9.6. Pre-computed reference benchmarks, revision 11920. 2015-12-26 19:40:22 +00:00
lda+U-noU.ref Initial commit test-suite based on TESTCODE, v0.9.6. Pre-computed reference benchmarks, revision 11920. 2015-12-26 19:40:22 +00:00
lda+U-user_ns.in Initial commit test-suite based on TESTCODE, v0.9.6. Pre-computed reference benchmarks, revision 11920. 2015-12-26 19:40:22 +00:00
lda+U-user_ns.ref Initial commit test-suite based on TESTCODE, v0.9.6. Pre-computed reference benchmarks, revision 11920. 2015-12-26 19:40:22 +00:00
lda+U.in Initial commit test-suite based on TESTCODE, v0.9.6. Pre-computed reference benchmarks, revision 11920. 2015-12-26 19:40:22 +00:00
lda+U.ref Initial commit test-suite based on TESTCODE, v0.9.6. Pre-computed reference benchmarks, revision 11920. 2015-12-26 19:40:22 +00:00
lda+U_background_one_channel.in [skip-CI] Miscellaneous changes to test-suite to avoid bogus errors after 2020-06-02 08:20:54 +00:00
lda+U_background_two_channels.in 1. Debugging of the DFT+U implementation with "background" 2020-04-24 17:45:01 +02:00
lda+U_force.in Initial commit test-suite based on TESTCODE, v0.9.6. Pre-computed reference benchmarks, revision 11920. 2015-12-26 19:40:22 +00:00
lda+U_force.ref Initial commit test-suite based on TESTCODE, v0.9.6. Pre-computed reference benchmarks, revision 11920. 2015-12-26 19:40:22 +00:00
lda+U_force_stress_ortho.in 1) DFT+U+V: moved sc_size to Modules/parameters.f90. 2020-07-08 19:05:00 +00:00
lda+U_gamma.in Initial commit test-suite based on TESTCODE, v0.9.6. Pre-computed reference benchmarks, revision 11920. 2015-12-26 19:40:22 +00:00
lda+U_gamma.ref Initial commit test-suite based on TESTCODE, v0.9.6. Pre-computed reference benchmarks, revision 11920. 2015-12-26 19:40:22 +00:00
lda+U_kind1_collin.in Added two test to the test-suite: 2020-04-21 15:46:13 +02:00
lda+U_kind1_noncollin.in Added two test to the test-suite: 2020-04-21 15:46:13 +02:00
lda+U_pseudo.in Initial commit test-suite based on TESTCODE, v0.9.6. Pre-computed reference benchmarks, revision 11920. 2015-12-26 19:40:22 +00:00