Delete all the pseudos on top -- Lorenzo Paulatto Written on a virtual keyboard with real fingers
On 10 Sep 2018 03:06, "Daniel Ortiz Gutierrez" <dort...@cinvestav.mx> wrote: Thank Dr. Pietro, i ran the clean_ps script and the make run-tests-pw-parallel, but the problem persist, the pseudopotentials directory's content after to download is: ls pseudo/ Al.pz-vbc.UPF H.blyp-vbc.UPF O.pz-rrkjus.UPF As.pz-bhs.UPF H.coulomb-ae.UPF O.pz-van_ak.UPF Au.pz-rrkjus_aewfc.UPF H.pbe-kjpaw.UPF O_US.van clean_ps H.pz-vbc.UPF Pb.pz-d-van.UPF CorelUSPBE.RRKJ3.UPF H.tpss-mt.UPF Pt.rel-pbe-n-rrkjus.UPF C.pbe-mt_gipaw.UPF HUSPBE.RRKJ3 Pt.rel-pz-n-rrkjus.UPF C.pbe-n-kjpaw_psl.0.1.UPF H_US.van Rh.pbe-rrkjus_lb.UPF C.pbe-rrkjus.UPF Ni.pbe-nd-rrkjus.UPF Rhs.pbe-rrkjus_lb.UPF C.pbe-van_bm.UPF Ni.pz-nd-rrkjus.UPF rVV10_kernel_table C.pz-rrkjus.UPF Ni.rel-pbe-nd-rrkjus.UPF Si.bhs C.tpss-mt.UPF N.pbe-kjpaw.UPF Si.pbe-rrkj.UPF Cu.pbe-kjpaw.UPF O.blyp-mt.UPF Si.pz-vbc.UPF Cu.pz-d-rrkjus.UPF O.pbe-kjpaw.UPF Si.rel-pbe-rrkj.UPF Fe.pz-nd-rrkjus.UPF O.pbe-rrkjus.UPF Ti.pz-sp-van_ak.UPF Ge.pbe-kjpaw.UPF O.pz-kjpaw.UPF vdW_kernel_table is this okay? Regards Daniel Ortiz On 09/09/2018 12:37 AM, Pietro Delugas wrote: Hi Daniel There was some problem while updating pseudopotentials in the site. For a short time some paw files had the wrong content. Now everything is fine. Just go to the pseudo directory and run the clean_ps script, then retry the tests. Regards Pietro Il 09 set 2018 6:05 AM, Daniel Ortiz Gutierrez <dort...@cinvestav.mx> <dort...@cinvestav.mx> ha scritto: Hello, I have a issue to running test-suite qe-6.3.1, the error is: *pw_vdw - xdm.in <http://xdm.in>: **FAILED**.* *Different sets of data extracted from benchmark and test.* * Data only in benchmark: f1, n1, e1, band, ef1.* *All done. ERROR: only 183 out of 184 tests passed.* *Failed test in:* * /lustre/.root/qe/qe-6.3/test-suite/pw_vdw/* *make: *** [run-tests-pw-parallel] Error 1* And the output file test.out.080918.inp\=xdm.in show: ....... * Error in routine init_xdm (1):* * XDM only implemented for PAW* ....... Thanks in advance. Regards, Daniel Ortiz _______________________________________________ users mailing listusers@lists.quantum-espresso.orghttps://lists.quantum-espresso.org/mailman/listinfo/users _______________________________________________ users mailing list users@lists.quantum-espresso.org https://lists.quantum-espresso.org/mailman/listinfo/users
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