Package evaluation of WannierIO on Julia 1.11.5 (32ac370b68*) started at 2025-06-29T07:39:01.096 ################################################################################ # Set-up # Installing PkgEval dependencies (TestEnv)... Set-up completed after 8.75s ################################################################################ # Installation # Installing WannierIO... Resolving package versions... Updating `~/.julia/environments/v1.11/Project.toml` [cb1bc77f] + WannierIO v0.2.8 Updating `~/.julia/environments/v1.11/Manifest.toml` [8bb1440f] + DelimitedFiles v1.9.1 [ffbed154] + DocStringExtensions v0.9.5 [8f5d6c58] + EzXML v1.2.1 [c58ffaec] + FortranFiles v0.6.0 [692b3bcd] + JLLWrappers v1.7.0 [bac558e1] + OrderedCollections v1.8.1 ⌅ [aea7be01] + PrecompileTools v1.2.1 [21216c6a] + Preferences v1.4.3 [90137ffa] + StaticArrays v1.9.13 [1e83bf80] + StaticArraysCore v1.4.3 [cb1bc77f] + WannierIO v0.2.8 [94ce4f54] + Libiconv_jll v1.18.0+0 ⌅ [02c8fc9c] + XML2_jll v2.13.6+1 [56f22d72] + Artifacts v1.11.0 [ade2ca70] + Dates v1.11.0 [8f399da3] + Libdl v1.11.0 [37e2e46d] + LinearAlgebra v1.11.0 [a63ad114] + Mmap v1.11.0 [de0858da] + Printf v1.11.0 [9a3f8284] + Random v1.11.0 [ea8e919c] + SHA v0.7.0 [fa267f1f] + TOML v1.0.3 [4ec0a83e] + Unicode v1.11.0 [e66e0078] + CompilerSupportLibraries_jll v1.1.1+0 [4536629a] + OpenBLAS_jll v0.3.27+1 [83775a58] + Zlib_jll v1.2.13+1 [8e850b90] + libblastrampoline_jll v5.11.0+0 Info Packages marked with ⌅ have new versions available but compatibility constraints restrict them from upgrading. To see why use `status --outdated -m` Installation completed after 1.99s ################################################################################ # Precompilation # Precompiling PkgEval dependencies... Precompiling package dependencies... Precompilation completed after 17.79s ################################################################################ # Testing # Testing WannierIO Status `/tmp/jl_sGoMcC/Project.toml` [bac558e1] OrderedCollections v1.8.1 [f8b46487] TestItemRunner v1.1.0 [cb1bc77f] WannierIO v0.2.8 [4af54fe1] LazyArtifacts v1.11.0 [37e2e46d] LinearAlgebra v1.11.0 [de0858da] Printf v1.11.0 [8dfed614] Test v1.11.0 Status `/tmp/jl_sGoMcC/Manifest.toml` [8bb1440f] DelimitedFiles v1.9.1 [ffbed154] DocStringExtensions v0.9.5 [8f5d6c58] EzXML v1.2.1 [c58ffaec] FortranFiles v0.6.0 [692b3bcd] JLLWrappers v1.7.0 [bac558e1] OrderedCollections v1.8.1 ⌅ [aea7be01] PrecompileTools v1.2.1 [21216c6a] Preferences v1.4.3 [90137ffa] StaticArrays v1.9.13 [1e83bf80] StaticArraysCore v1.4.3 [f8b46487] TestItemRunner v1.1.0 [1c621080] TestItems v1.0.0 [cb1bc77f] WannierIO v0.2.8 [94ce4f54] Libiconv_jll v1.18.0+0 ⌅ [02c8fc9c] XML2_jll v2.13.6+1 [0dad84c5] ArgTools v1.1.2 [56f22d72] Artifacts v1.11.0 [2a0f44e3] Base64 v1.11.0 [ade2ca70] Dates v1.11.0 [f43a241f] Downloads v1.6.0 [7b1f6079] FileWatching v1.11.0 [b77e0a4c] InteractiveUtils v1.11.0 [4af54fe1] LazyArtifacts v1.11.0 [b27032c2] LibCURL v0.6.4 [76f85450] LibGit2 v1.11.0 [8f399da3] Libdl v1.11.0 [37e2e46d] LinearAlgebra v1.11.0 [56ddb016] Logging v1.11.0 [d6f4376e] Markdown v1.11.0 [a63ad114] Mmap v1.11.0 [ca575930] NetworkOptions v1.2.0 [44cfe95a] Pkg v1.11.0 [de0858da] Printf v1.11.0 [9a3f8284] Random v1.11.0 [ea8e919c] SHA v0.7.0 [9e88b42a] Serialization v1.11.0 [fa267f1f] TOML v1.0.3 [a4e569a6] Tar v1.10.0 [8dfed614] Test v1.11.0 [cf7118a7] UUIDs v1.11.0 [4ec0a83e] Unicode v1.11.0 [e66e0078] CompilerSupportLibraries_jll v1.1.1+0 [deac9b47] LibCURL_jll v8.6.0+0 [e37daf67] LibGit2_jll v1.7.2+0 [29816b5a] LibSSH2_jll v1.11.0+1 [c8ffd9c3] MbedTLS_jll v2.28.6+0 [14a3606d] MozillaCACerts_jll v2023.12.12 [4536629a] OpenBLAS_jll v0.3.27+1 [83775a58] Zlib_jll v1.2.13+1 [8e850b90] libblastrampoline_jll v5.11.0+0 [8e850ede] nghttp2_jll v1.59.0+0 [3f19e933] p7zip_jll v17.4.0+2 Info Packages marked with ⌅ have new versions available but compatibility constraints restrict them from upgrading. Testing Running tests... ┌ Info: Reading mmn file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/Si2_valence.mmn" │ header = "Created on 15Jun2023 at 10:34: 5" │ n_kpts = 216 │ n_bvecs = 8 └ n_bands = 4 ┌ Info: Writing mmn file │ filename = "/tmp/jl_sNuju7UhmX" │ header = "# Created by WannierIO.jl 2025-06-29T07:41:00.277" │ n_kpts = 216 │ n_bvecs = 8 └ n_bands = 4 ┌ Info: Reading mmn file │ filename = "/tmp/jl_sNuju7UhmX" │ header = "# Created by WannierIO.jl 2025-06-29T07:41:00.277" │ n_kpts = 216 │ n_bvecs = 8 └ n_bands = 4 ┌ Info: Reading mmn file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/Si2_valence.mmn" │ header = "Created on 15Jun2023 at 10:34: 5" │ n_kpts = 216 │ n_bvecs = 8 └ n_bands = 4 ┌ Info: Reading mmn file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/binary/Si2_valence.mmn" │ header = "Created on 15Jun2023 at 10:52:19" │ n_kpts = 216 │ n_bvecs = 8 └ n_bands = 4 ┌ Info: Writing mmn file │ filename = "/tmp/jl_f4x4dQFo3E" │ header = "# Created by WannierIO.jl 2025-06-29T07:41:12.400" │ n_kpts = 216 │ n_bvecs = 8 └ n_bands = 4 ┌ Info: Reading mmn file │ filename = "/tmp/jl_f4x4dQFo3E" │ header = "# Created by WannierIO.jl 2025-06-29T07:41:12.400" │ n_kpts = 216 │ n_bvecs = 8 └ n_bands = 4 ┌ Info: Reading uHu file │ filename = "/home/pkgeval/.julia/artifacts/61ccd2c018e0934c3541b85c32a8bd0ee957e2d7/test/Fe.uHu.fmt" │ header = " Created on 5Aug2023 at 11: 7:23 " │ n_kpts = 8 │ n_bvecs = 12 └ n_bands = 4 ┌ Info: Writing uHu file │ filename = "/tmp/jl_4pcZuHo12p" │ header = "# Created by WannierIO.jl 2025-06-29T07:41:18.835" │ n_kpts = 8 │ n_bands = 4 └ n_bvecs = 12 ┌ Info: Reading uHu file │ filename = "/tmp/jl_4pcZuHo12p" │ header = "# Created by WannierIO.jl 2025-06-29T07:41:18.835" │ n_kpts = 8 │ n_bvecs = 12 └ n_bands = 4 ┌ Info: Reading uHu file │ filename = "/home/pkgeval/.julia/artifacts/61ccd2c018e0934c3541b85c32a8bd0ee957e2d7/test/Fe.uHu" │ header = "Created on 5Aug2023 at 11: 9:11" │ n_kpts = 8 │ n_bvecs = 12 └ n_bands = 4 ┌ Info: Reading uHu file │ filename = "/home/pkgeval/.julia/artifacts/61ccd2c018e0934c3541b85c32a8bd0ee957e2d7/test/Fe.uHu.fmt" │ header = " Created on 5Aug2023 at 11: 7:23 " │ n_kpts = 8 │ n_bvecs = 12 └ n_bands = 4 ┌ Info: Writing uHu file │ filename = "/tmp/jl_b4FWzg5Cxk" │ header = "# Created by WannierIO.jl 2025-06-29T07:41:25.077" │ n_kpts = 8 │ n_bands = 4 └ n_bvecs = 12 ┌ Info: Reading uHu file │ filename = "/tmp/jl_b4FWzg5Cxk" │ header = "# Created by WannierIO.jl 2025-06-29T07:41:25.077" │ n_kpts = 8 │ n_bvecs = 12 └ n_bands = 4 ┌ Info: Reading wsvec.dat file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/MDRS/Si2_valence_wsvec.dat" │ header = "## written on 15Jun2023 at 18:03:39 with use_ws_distance=.true." │ mdrs = true │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Writing wsvec.dat file │ filename = "/tmp/jl_kl2jw3yRgd" │ header = "# Created by WannierIO.jl 2025-06-29T07:41:29.957" │ mdrs = false │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading wsvec.dat file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/MDRS/Si2_valence_wsvec.dat" │ header = "## written on 15Jun2023 at 18:03:39 with use_ws_distance=.true." │ mdrs = true │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Writing wsvec.dat file │ filename = "/tmp/jl_PkrW76hkvc" │ header = "# Created by WannierIO.jl 2025-06-29T07:41:30.797" │ mdrs = true │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading wsvec.dat file │ filename = "/tmp/jl_PkrW76hkvc" │ header = "# Created by WannierIO.jl 2025-06-29T07:41:30.797 with use_ws_distance=.true." │ mdrs = true │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Writing wsvec.dat file │ filename = "/tmp/jl_PkrW76hkvc" │ header = "# Created by WannierIO.jl 2025-06-29T07:41:31.567" │ mdrs = true │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading wsvec.dat file │ filename = "/tmp/jl_PkrW76hkvc" │ header = "# Created by WannierIO.jl 2025-06-29T07:41:31.567 with use_ws_distance=.true." │ mdrs = true │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading tb.dat file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/WS/Si2_valence_tb.dat" │ header = "written on 15Jun2023 at 18:06:43" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading tb.dat file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/MDRS/Si2_valence_tb.dat" │ header = "written on 15Jun2023 at 18:03:38" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading tb.dat file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/WS/Si2_valence_tb.dat" │ header = "written on 15Jun2023 at 18:06:43" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading tb.dat file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/WS/Si2_valence_tb.dat" │ header = "written on 15Jun2023 at 18:06:43" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Writing tb.dat file │ filename = "/tmp/jl_xqDGT6jwHO" │ header = "written on 15Jun2023 at 18:06:43" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading tb.dat file │ filename = "/tmp/jl_xqDGT6jwHO" │ header = "written on 15Jun2023 at 18:06:43" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading tb.dat file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/MDRS/Si2_valence_tb.dat" │ header = "written on 15Jun2023 at 18:03:38" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Writing tb.dat file │ filename = "/tmp/jl_WvaZQx6HUN" │ header = "written on 15Jun2023 at 18:03:38" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading tb.dat file │ filename = "/tmp/jl_WvaZQx6HUN" │ header = "written on 15Jun2023 at 18:03:38" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading cube file: └ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/Si2_valence_00001.cube" Generated by Wannier90 code http://www.wannier.org On 15Jun2023 at 11:01:22 ┌ Info: Writing cube file: └ filename = "/tmp/jl_tAFYFwxSXc" ┌ Info: Reading cube file: └ filename = "/tmp/jl_tAFYFwxSXc" # Created by WannierIO.jl 2025-06-29T07:42:23.884 outer loop: x, middle loop: y, inner loop: z ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/1459f891f478ff64c3d1296c634ad441611778b2/outputs/Si2.chk.fmt" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading u_mat file │ filename = "/home/pkgeval/.julia/artifacts/1459f891f478ff64c3d1296c634ad441611778b2/outputs/Si2_u.mat" │ header = "written on 15Mar2024 at 14:50:53" │ nkpts = 729 │ nbands = 8 └ nwann = 8 ┌ Info: Writing u_mat file │ filename = "/tmp/jl_PY3MX4TMpW" │ header = "# Created by WannierIO.jl 2025-06-29T07:42:56.582" │ nkpts = 729 │ nbands = 8 └ nwann = 8 ┌ Info: Reading u_mat file │ filename = "/tmp/jl_PY3MX4TMpW" │ header = "# Created by WannierIO.jl 2025-06-29T07:42:56.582" │ nkpts = 729 │ nbands = 8 └ nwann = 8 ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/1459f891f478ff64c3d1296c634ad441611778b2/outputs/Si2.chk.fmt" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading u_mat file │ filename = "/home/pkgeval/.julia/artifacts/1459f891f478ff64c3d1296c634ad441611778b2/outputs/Si2_u_dis.mat" │ header = "written on 15Mar2024 at 14:50:53" │ nkpts = 729 │ nbands = 16 └ nwann = 8 ┌ Info: Writing u_mat file │ filename = "/tmp/jl_2jYba9GhEp" │ header = "# Created by WannierIO.jl 2025-06-29T07:42:57.774" │ nkpts = 729 │ nbands = 16 └ nwann = 8 ┌ Info: Reading u_mat file │ filename = "/tmp/jl_2jYba9GhEp" │ header = "# Created by WannierIO.jl 2025-06-29T07:42:57.774" │ nkpts = 729 │ nbands = 16 └ nwann = 8 ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/Si2_valence.win" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (6, 6, 6) ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/Si2_valence.win.toml" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (6, 6, 6) ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/Si2_valence.win" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (6, 6, 6) ┌ Info: Writing win file │ filename = "/tmp/jl_TAzwRwbGvu" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (6, 6, 6) ┌ Info: Reading win file │ filename = "/tmp/jl_TAzwRwbGvu" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (6, 6, 6) ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/Si2_valence.win.toml" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (6, 6, 6) ┌ Info: Writing win file │ filename = "/tmp/jl_Iv0FW9Uled" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (6, 6, 6) ┌ Info: Reading win file │ filename = "/tmp/jl_Iv0FW9Uled" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (6, 6, 6) ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/packages/WannierIO/HDhR8/test/w90/win_testfiles/atoms_cart_bohr.win" │ num_wann = 8 │ num_bands = 8 └ mp_grid = (1, 1, 2) ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/packages/WannierIO/HDhR8/test/w90/win_testfiles/capital_block_name.win" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (1, 1, 1) ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/packages/WannierIO/HDhR8/test/w90/win_testfiles/ending_newline.win" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (1, 1, 1) ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/packages/WannierIO/HDhR8/test/w90/win_testfiles/exclude_bands.win" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (1, 1, 1) ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/packages/WannierIO/HDhR8/test/w90/win_testfiles/unknown_blocks.win" │ num_wann = 8 │ num_bands = 8 └ mp_grid = (1, 1, 2) ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/packages/WannierIO/HDhR8/test/w90/win_testfiles/unknown_blocks.win" │ num_wann = 8 │ num_bands = 8 └ mp_grid = (1, 1, 2) ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/packages/WannierIO/HDhR8/test/w90/win_testfiles/unknown_blocks.win" │ num_wann = 8 │ num_bands = 8 └ mp_grid = (1, 1, 2) ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/packages/WannierIO/HDhR8/test/w90/win_testfiles/atoms_cart_bohr.win" │ num_wann = 8 │ num_bands = 8 └ mp_grid = (1, 1, 2) ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/packages/WannierIO/HDhR8/test/w90/win_testfiles/exclude_bands.win" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (1, 1, 1) ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/artifacts/bfdffa9983ba6801e7dec5c197fac959f756b02b/GaAs.win" │ num_wann = 8 │ num_bands = 20 └ mp_grid = (9, 9, 9) ┌ Info: Writing win file │ filename = "/tmp/jl_Vy3mdufy1g" │ num_wann = 8 │ num_bands = 20 └ mp_grid = (9, 9, 9) ┌ Info: Reading win file │ filename = "/tmp/jl_Vy3mdufy1g" │ num_wann = 8 │ num_bands = 20 └ mp_grid = (9, 9, 9) ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/artifacts/bfdffa9983ba6801e7dec5c197fac959f756b02b/GaAs.win" │ num_wann = 8 │ num_bands = 20 └ mp_grid = (9, 9, 9) ┌ Info: Writing win file │ filename = "/tmp/jl_e5YTolQ5Yx" │ num_wann = 8 │ num_bands = 20 └ mp_grid = (9, 9, 9) ┌ Info: Reading win file │ filename = "/tmp/jl_e5YTolQ5Yx" │ num_wann = 8 │ num_bands = 20 └ mp_grid = (9, 9, 9) ┌ Info: Reading spn file │ filename = "/home/pkgeval/.julia/artifacts/61ccd2c018e0934c3541b85c32a8bd0ee957e2d7/test/Fe.spn.fmt" │ header = " Created on 5Aug2023 at 11: 7:23 " │ n_kpts = 8 └ n_bands = 4 ┌ Info: Writing spn file │ filename = "/tmp/jl_ncNqzsrcJ4" │ header = "# Created by WannierIO.jl 2025-06-29T07:43:35.892" │ n_kpts = 8 └ n_bands = 4 ┌ Info: Reading spn file │ filename = "/tmp/jl_ncNqzsrcJ4" │ header = "# Created by WannierIO.jl 2025-06-29T07:43:35.892" │ n_kpts = 8 └ n_bands = 4 ┌ Info: Reading spn file │ filename = "/home/pkgeval/.julia/artifacts/61ccd2c018e0934c3541b85c32a8bd0ee957e2d7/test/Fe.spn" │ header = "Created on 5Aug2023 at 11: 9:11" │ n_kpts = 8 └ n_bands = 4 ┌ Info: Reading spn file │ filename = "/home/pkgeval/.julia/artifacts/61ccd2c018e0934c3541b85c32a8bd0ee957e2d7/test/Fe.spn.fmt" │ header = " Created on 5Aug2023 at 11: 7:23 " │ n_kpts = 8 └ n_bands = 4 ┌ Info: Writing spn file │ filename = "/tmp/jl_O30ZKpy5a1" │ header = "# Created by WannierIO.jl 2025-06-29T07:43:36.658" │ n_kpts = 8 └ n_bands = 4 ┌ Info: Reading spn file │ filename = "/tmp/jl_O30ZKpy5a1" │ header = "# Created by WannierIO.jl 2025-06-29T07:43:36.658" │ n_kpts = 8 └ n_bands = 4 ┌ Info: Writing bxsf file: └ filename = "/tmp/jl_nsfSH2ZWlS" ┌ Info: Reading hr.dat file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/WS/Si2_valence_hr.dat" │ header = "written on 15Jun2023 at 18:06:42" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading hr.dat file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/WS/Si2_valence_hr.dat" │ header = "written on 15Jun2023 at 18:06:42" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading hr.dat file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/WS/Si2_valence_hr.dat" │ header = "written on 15Jun2023 at 18:06:42" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading hr.dat file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/WS/Si2_valence_hr.dat" │ header = "written on 15Jun2023 at 18:06:42" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Writing hr.dat file │ filename = "/tmp/jl_kHA3gp8NwL" │ header = "written on 15Jun2023 at 18:06:42" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading hr.dat file │ filename = "/tmp/jl_kHA3gp8NwL" │ header = "written on 15Jun2023 at 18:06:42" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading unk file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/UNK/UNK00001.1" │ ik = 1 │ (n_gx, n_gy, n_gz) = (13, 13, 13) │ n_bands = 4 └ n_spin = 1 ┌ Info: Writing unk file │ filename = "/tmp/jl_tS5S743Khg" │ ik = 1 │ (n_gx, n_gy, n_gz) = (13, 13, 13) │ n_bands = 4 └ n_spin = 1 ┌ Info: Reading unk file │ filename = "/tmp/jl_tS5S743Khg" │ ik = 1 │ (n_gx, n_gy, n_gz) = (13, 13, 13) │ n_bands = 4 └ n_spin = 1 ┌ Info: Reading unk file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/UNK/UNK00001.1" │ ik = 1 │ (n_gx, n_gy, n_gz) = (13, 13, 13) │ n_bands = 4 └ n_spin = 1 ┌ Info: Reading unk file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/binary/UNK00001.1" │ ik = 1 │ (n_gx, n_gy, n_gz) = (13, 13, 13) │ n_bands = 4 └ n_spin = 1 ┌ Info: Writing unk file │ filename = "/tmp/jl_qByROzyzeN" │ ik = 1 │ (n_gx, n_gy, n_gz) = (13, 13, 13) │ n_bands = 4 └ n_spin = 1 ┌ Info: Reading unk file │ filename = "/tmp/jl_qByROzyzeN" │ ik = 1 │ (n_gx, n_gy, n_gz) = (13, 13, 13) │ n_bands = 4 └ n_spin = 1 ┌ Info: Reading mmn file │ filename = "/home/pkgeval/.julia/artifacts/5c6644b683c4783271d99973e21156daa2075bac/BN.mmn" │ header = "Created on 4Oct2023 at 17:49:26" │ n_kpts = 64 │ n_bvecs = 8 └ n_bands = 3 ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/5c6644b683c4783271d99973e21156daa2075bac/outputs/bn.chk" │ n_kpts = 64 │ n_bands = 3 └ n_wann = 3 ┌ Info: Reading ukk file │ filename = "/home/pkgeval/.julia/artifacts/5c6644b683c4783271d99973e21156daa2075bac/outputs/bn.ukk" │ n_kpts = 64 │ n_bands = 3 └ n_wann = 3 Written to /tmp/jl_oV6DuhwjIv ┌ Info: Reading ukk file │ filename = "/tmp/jl_oV6DuhwjIv" │ n_kpts = 64 │ n_bands = 3 └ n_wann = 3 ┌ Info: Reading nnkp file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/Si2_valence.nnkp" │ n_kpts = 216 └ n_bvecs = 8 ┌ Info: Reading nnkp file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/Si2_valence.nnkp.toml" │ n_kpts = 216 └ n_bvecs = 8 ┌ Info: Reading nnkp file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/Si2_valence.nnkp" │ n_kpts = 216 └ n_bvecs = 8 ┌ Info: Writing nnkp file │ filename = "/tmp/jl_SvIXAd6xWt" │ n_kpts = 216 └ n_bvecs = 8 ┌ Info: Reading nnkp file │ filename = "/tmp/jl_SvIXAd6xWt" │ n_kpts = 216 └ n_bvecs = 8 ┌ Info: Reading nnkp file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/Si2_valence.nnkp.toml" │ n_kpts = 216 └ n_bvecs = 8 ┌ Info: Writing nnkp file │ filename = "/tmp/jl_hgjInI1ozI" │ n_kpts = 216 └ n_bvecs = 8 ┌ Info: Reading nnkp file │ filename = "/tmp/jl_hgjInI1ozI" │ n_kpts = 216 └ n_bvecs = 8 ┌ Info: Reading nnkp file │ filename = "/home/pkgeval/.julia/artifacts/b45310314ba59112420850678fa416fcbbd7aa6a/outputs/SnSe2.nnkp" │ n_kpts = 500 └ n_bvecs = 10 ┌ Info: Writing nnkp file │ filename = "/tmp/jl_89aBEn6hAX" │ n_kpts = 500 └ n_bvecs = 10 ┌ Info: Reading nnkp file │ filename = "/tmp/jl_89aBEn6hAX" │ n_kpts = 500 └ n_bvecs = 10 ┌ Info: Reading Wannier90 band files │ band_dat = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/MDRS/Si2_valence_band.dat" │ band_kpt = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/MDRS/Si2_valence_band.kpt" │ band_labelinfo = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/MDRS/Si2_valence_band.labelinfo.dat" │ n_kpts = 511 └ n_symm = 8 ┌ Info: Writing Wannier90 band files │ band_kpt = "/tmp/jl_3gARIw/Si2_valence_band.kpt" │ band_dat = "/tmp/jl_3gARIw/Si2_valence_band.dat" │ band_labelinfo = "/tmp/jl_3gARIw/Si2_valence_band.labelinfo.dat" │ n_kpts = 511 └ n_symm = 8 ┌ Info: Reading Wannier90 band files │ band_dat = "/tmp/jl_3gARIw/Si2_valence_band.dat" │ band_kpt = "/tmp/jl_3gARIw/Si2_valence_band.kpt" │ band_labelinfo = "/tmp/jl_3gARIw/Si2_valence_band.labelinfo.dat" │ n_kpts = 511 └ n_symm = 8 ┌ Info: Reading amn file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/Si2_valence.amn" │ header = "Created on 15Jun2023 at 10:34: 3" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Writing amn file │ filename = "/tmp/jl_GPQf6PW7Wt" │ header = "# Created by WannierIO.jl 2025-06-29T07:45:14.517" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading amn file │ filename = "/tmp/jl_GPQf6PW7Wt" │ header = "# Created by WannierIO.jl 2025-06-29T07:45:14.517" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading amn file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/Si2_valence.amn" │ header = "Created on 15Jun2023 at 10:34: 3" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading amn file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/binary/Si2_valence.amn" │ header = "Created on 15Jun2023 at 10:52:19" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Writing amn file │ filename = "/tmp/jl_zerOfUhebe" │ header = "# Created by WannierIO.jl 2025-06-29T07:45:15.740" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading amn file │ filename = "/tmp/jl_zerOfUhebe" │ header = "# Created by WannierIO.jl 2025-06-29T07:45:15.740" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading eig file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/Si2_valence.eig" │ n_kpts = 216 └ n_bands = 4 ┌ Info: Writing eig file │ filename = "/tmp/jl_6dC3c9UPQ3" │ n_kpts = 216 └ n_bands = 4 ┌ Info: Reading eig file │ filename = "/tmp/jl_6dC3c9UPQ3" │ n_kpts = 216 └ n_bands = 4 ┌ Info: Reading eig file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/Si2_valence.eig" │ n_kpts = 216 └ n_bands = 4 ┌ Info: Reading eig file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/binary/Si2_valence.eig" │ n_kpts = 216 └ n_bands = 4 ┌ Info: Writing eig file │ filename = "/tmp/jl_JYtIfavgDk" │ n_kpts = 216 └ n_bands = 4 ┌ Info: Reading eig file │ filename = "/tmp/jl_JYtIfavgDk" │ n_kpts = 216 └ n_bands = 4 ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/Si2_valence.chk.fmt" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/Si2_valence.win" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (6, 6, 6) ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/Si2_valence.chk.fmt" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Writing chk file │ filename = "/tmp/jl_hITah0bwta" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading chk file │ filename = "/tmp/jl_hITah0bwta" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/Si2_valence.chk.fmt" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/binary/Si2_valence.chk" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Writing chk file │ filename = "/tmp/jl_eJ0dajcjEb" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading chk file │ filename = "/tmp/jl_eJ0dajcjEb" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/1459f891f478ff64c3d1296c634ad441611778b2/outputs/Si2.chk.fmt" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/1459f891f478ff64c3d1296c634ad441611778b2/outputs/Si2.chk.fmt" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Writing chk file │ filename = "/tmp/jl_gXy5uPspat" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading chk file │ filename = "/tmp/jl_gXy5uPspat" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/1459f891f478ff64c3d1296c634ad441611778b2/outputs/Si2.chk.fmt" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/1459f891f478ff64c3d1296c634ad441611778b2/outputs/Si2.chk" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Writing chk file │ filename = "/tmp/jl_Hutyd69GHA" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading chk file │ filename = "/tmp/jl_Hutyd69GHA" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/1459f891f478ff64c3d1296c634ad441611778b2/outputs/Si2.chk" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading amn file │ filename = "/home/pkgeval/.julia/artifacts/1459f891f478ff64c3d1296c634ad441611778b2/outputs/Si2.chk_Udis.amn" │ header = "Created by WannierIO.jl 2023-06-15T14:14:17.730" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/1459f891f478ff64c3d1296c634ad441611778b2/outputs/Si2.chk" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading amn file │ filename = "/home/pkgeval/.julia/artifacts/1459f891f478ff64c3d1296c634ad441611778b2/outputs/Si2.chk_U.amn" │ header = "Created by WannierIO.jl 2023-06-15T14:14:28.014" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/61ccd2c018e0934c3541b85c32a8bd0ee957e2d7/outputs/Fe.chk" │ n_kpts = 125 │ n_bands = 22 └ n_wann = 16 ┌ Info: Writing chk file │ filename = "/tmp/jl_GLqxAnEFwB" │ n_kpts = 125 │ n_bands = 22 └ n_wann = 16 ┌ Info: Reading chk file │ filename = "/tmp/jl_GLqxAnEFwB" │ n_kpts = 125 │ n_bands = 22 └ n_wann = 16 ┌ Info: Reading r.dat file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/WS/Si2_valence_r.dat" │ header = "written on 15Jun2023 at 18:06:42" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading r.dat file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/MDRS/Si2_valence_r.dat" │ header = "written on 15Jun2023 at 18:03:37" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading r.dat file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/WS/Si2_valence_r.dat" │ header = "written on 15Jun2023 at 18:06:42" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading r.dat file │ filename = "/home/pkgeval/.julia/artifacts/69abcb33e42a08354b68dae0c4ced116b6234d70/outputs/WS/Si2_valence_r.dat" │ header = "written on 15Jun2023 at 18:06:42" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Writing r.dat file │ filename = "/tmp/jl_HMHmbMNkp8" │ header = "written on 15Jun2023 at 18:06:42" │ n_wann = 4 └ n_Rvecs = 279 ┌ Info: Reading r.dat file │ filename = "/tmp/jl_HMHmbMNkp8" │ header = "written on 15Jun2023 at 18:06:42" │ n_wann = 4 └ n_Rvecs = 279 Test Summary: | Pass Total Time Package | 368 368 5m05.9s test/w90/mmn.jl | 15 15 39.1s read/write mmn | 9 9 38.6s read/write mmn binary | 6 6 0.4s test/w90/uHu.jl | 7 7 13.0s read/write uHu | 5 5 11.1s read/write uHu binary | 2 2 1.9s test/w90/wsvec.jl | 26 26 6.1s read wsvec WS | 3 3 2.2s read wsvec MDRS | 7 7 1.2s write wsvec WS | 4 4 1.4s write wsvec MDRS | 12 12 1.3s test/common/type.jl | 10 10 3.2s vec3 mat3 | 6 6 3.0s symbolvec3 | 4 4 0.2s test/qe/xml.jl | 24 24 24.5s read qe xml | 13 13 24.2s read qe xml spin-polarized | 11 11 0.3s test/util/parser.jl | 6 6 1.5s parse_vector | 2 2 0.7s format_indices | 2 2 0.3s parse_indices | 2 2 0.4s test/w90/tb.jl | 34 34 9.9s read tb WS | 11 11 3.5s read tb MDRS | 7 7 1.0s write tb WS | 8 8 5.1s write tb MDRS | 8 8 0.2s test/volume/cube.jl | 16 16 32.9s read/write cube | 16 16 32.9s test/util/toml.jl | 3 3 2.1s write_toml | 3 3 2.1s test/w90/u_mat.jl | 0 12.1s read/write u.mat | 0 10.8s read/write u_dis.mat | 0 1.3s test/util/fortran.jl | 7 7 0.0s isbinary file | 2 2 0.0s parse_float | 1 1 0.0s parse_bool | 4 4 0.0s test/w90/win.jl | 20 20 31.0s read win | 1 1 12.7s read/write win | 1 1 12.2s read/write win toml | 1 1 2.5s read win: special cases | 5 5 0.4s read win: unknown blocks | 2 2 0.0s read win: atoms_cart bohr | 4 4 0.3s read win: exclude_bands | 1 1 0.0s read win: explicit_kpath | 4 4 1.8s write win: OrderedDict | 1 1 1.0s test/w90/spn.jl | 12 12 7.7s read/write spn | 6 6 6.8s read/write spn binary | 6 6 0.9s test/volume/bxsf.jl | 15 15 27.5s read/write bxsf | 15 15 27.5s test/w90/hr.jl | 11 11 2.9s read hr ws | 4 4 0.8s read hr mdrs | 3 3 0.1s write hr | 4 4 1.9s test/w90/unk.jl | 9 9 15.7s read/write unk | 5 5 15.1s read/write unk binary | 4 4 0.6s test/misc/epw.jl | 3 3 17.9s read EPW mmn | 1 1 0.7s read/write EPW ukk | 2 2 17.2s test/w90/nnkp.jl | 5 5 12.7s read nnkp | 1 1 5.9s read/write nnkp | 1 1 3.3s read/write nnkp toml | 1 1 1.2s read auto_projections | 2 2 2.3s test/w90/wout.jl | 65 65 11.7s _parse_wout_lattice | 1 1 0.4s _parse_wout_recip_lattice | 1 1 0.3s _parse_wout_atoms | 2 2 1.9s _parse_wout_disentangle | 4 4 0.3s _parse_wout_wf_center_spread | 4 4 0.6s _parse_wout_wannierize | 8 8 3.7s read wout | 14 14 3.1s read wout disentanglement | 10 10 0.1s read wout iterations | 18 18 1.1s read wout fortran stars | 3 3 0.2s test/w90/band.jl | 8 8 7.8s read/write w90 band dat | 8 8 7.8s test/w90/amn.jl | 6 6 2.8s read/write amn | 4 4 2.8s read/write amn binary | 2 2 0.1s test/w90/eig.jl | 6 6 2.0s read/write eig | 4 4 2.0s read/write eig binary | 2 2 0.1s test/w90/chk.jl | 47 47 17.5s read chk | 26 26 0.4s read/write chk | 1 1 7.3s read/write chk binary | 2 2 1.8s read chk disentanglement | 10 10 1.2s read/write chk disentanglement | 1 1 2.4s read/write chk disentanglement binary | 2 2 3.0s get_Udis | 1 1 0.2s get_U | 1 1 0.5s read/write chk lattice | 3 3 0.8s test/w90/r.jl | 13 13 4.1s read r WS | 4 4 1.2s read r MDRS | 4 4 0.1s write r | 5 5 2.7s Testing WannierIO tests passed Testing completed after 367.33s PkgEval succeeded after 403.33s