Package evaluation of WannierIO on Julia 1.12.0-DEV.2153 (83dcbd426d*) started at 2025-03-31T10:43:35.257 ################################################################################ # Set-up # Installing PkgEval dependencies (TestEnv)... Set-up completed after 9.2s ################################################################################ # Installation # Installing WannierIO... Resolving package versions... Installed XML2_jll ──────────── v2.13.6+1 Installed JLLWrappers ───────── v1.7.0 Installed DelimitedFiles ────── v1.9.1 Installed EzXML ─────────────── v1.2.1 Installed PrecompileTools ───── v1.3.0 Installed Preferences ───────── v1.4.3 Installed StaticArraysCore ──── v1.4.3 Installed DocStringExtensions ─ v0.9.4 Installed Libiconv_jll ──────── v1.18.0+0 Installed FortranFiles ──────── v0.6.0 Installed StaticArrays ──────── v1.9.13 Installed WannierIO ─────────── v0.2.6 Installing 2 artifacts Installed artifact Libiconv 1.9 MiB Installed artifact XML2 2.5 MiB Updating `~/.julia/environments/v1.12/Project.toml` [cb1bc77f] + WannierIO v0.2.6 Updating `~/.julia/environments/v1.12/Manifest.toml` [8bb1440f] + DelimitedFiles v1.9.1 [ffbed154] + DocStringExtensions v0.9.4 [8f5d6c58] + EzXML v1.2.1 [c58ffaec] + FortranFiles v0.6.0 [692b3bcd] + JLLWrappers v1.7.0 [aea7be01] + PrecompileTools v1.3.0 [21216c6a] + Preferences v1.4.3 [90137ffa] + StaticArrays v1.9.13 [1e83bf80] + StaticArraysCore v1.4.3 [cb1bc77f] + WannierIO v0.2.6 [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 v1.12.0 [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 v1.3.0+1 [4536629a] + OpenBLAS_jll v0.3.29+0 [83775a58] + Zlib_jll v1.3.1+2 [8e850b90] + libblastrampoline_jll v5.12.0+0 Installation completed after 5.15s ################################################################################ # Precompilation # Precompiling PkgEval dependencies... Precompiling packages... 6550.1 ms ✓ TestEnv 1 dependency successfully precompiled in 8 seconds. 25 already precompiled. Precompiling package dependencies... Precompilation completed after 94.35s ################################################################################ # Testing # Testing WannierIO Status `/tmp/jl_SZaCc6/Project.toml` ⌅ [4c88cf16] Aqua v0.5.6 ⌅ [f8b46487] TestItemRunner v0.2.3 [cb1bc77f] WannierIO v0.2.6 [4af54fe1] LazyArtifacts v1.11.0 [37e2e46d] LinearAlgebra v1.12.0 [de0858da] Printf v1.11.0 [8dfed614] Test v1.11.0 Status `/tmp/jl_SZaCc6/Manifest.toml` ⌅ [4c88cf16] Aqua v0.5.6 [34da2185] Compat v4.16.0 [8bb1440f] DelimitedFiles v1.9.1 [ffbed154] DocStringExtensions v0.9.4 [8f5d6c58] EzXML v1.2.1 [c58ffaec] FortranFiles v0.6.0 [692b3bcd] JLLWrappers v1.7.0 [aea7be01] PrecompileTools v1.3.0 [21216c6a] Preferences v1.4.3 [90137ffa] StaticArrays v1.9.13 [1e83bf80] StaticArraysCore v1.4.3 ⌅ [f8b46487] TestItemRunner v0.2.3 ⌅ [1c621080] TestItems v0.1.1 [cb1bc77f] WannierIO v0.2.6 [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 [ac6e5ff7] JuliaSyntaxHighlighting v1.12.0 [4af54fe1] LazyArtifacts v1.11.0 [b27032c2] LibCURL v0.6.4 [76f85450] LibGit2 v1.11.0 [8f399da3] Libdl v1.11.0 [37e2e46d] LinearAlgebra v1.12.0 [56ddb016] Logging v1.11.0 [d6f4376e] Markdown v1.11.0 [a63ad114] Mmap v1.11.0 [ca575930] NetworkOptions v1.3.0 [44cfe95a] Pkg v1.12.0 [de0858da] Printf v1.11.0 [9a3f8284] Random v1.11.0 [ea8e919c] SHA v0.7.0 [9e88b42a] Serialization v1.11.0 [f489334b] StyledStrings 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 v1.3.0+1 [deac9b47] LibCURL_jll v8.11.1+1 [e37daf67] LibGit2_jll v1.9.0+0 [29816b5a] LibSSH2_jll v1.11.3+1 [14a3606d] MozillaCACerts_jll v2024.12.31 [4536629a] OpenBLAS_jll v0.3.29+0 [458c3c95] OpenSSL_jll v3.0.16+0 [83775a58] Zlib_jll v1.3.1+2 [8e850b90] libblastrampoline_jll v5.12.0+0 [8e850ede] nghttp2_jll v1.64.0+1 [3f19e933] p7zip_jll v17.5.0+2 Info Packages marked with ⌅ have new versions available but compatibility constraints restrict them from upgrading. Testing Running tests... Downloading artifact: Si2_valence ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/03635d409d4449351ac87b8069c763de898c03af/reference/Si2_valence.chk.fmt" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/artifacts/03635d409d4449351ac87b8069c763de898c03af/Si2_valence.win" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (6, 6, 6) ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/03635d409d4449351ac87b8069c763de898c03af/reference/Si2_valence.chk.fmt" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Writing chk file │ filename = "/tmp/jl_c1KvC5wh23" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading chk file │ filename = "/tmp/jl_c1KvC5wh23" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/03635d409d4449351ac87b8069c763de898c03af/reference/Si2_valence.chk.fmt" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/03635d409d4449351ac87b8069c763de898c03af/reference/binary/Si2_valence.chk" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Writing chk file │ filename = "/tmp/jl_QryvGzWfgl" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading chk file │ filename = "/tmp/jl_QryvGzWfgl" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 Downloading artifact: Si2 ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/3fd6d3496ecb1c58334cff33e30998864ae16b66/reference/Si2.chk.fmt" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/3fd6d3496ecb1c58334cff33e30998864ae16b66/reference/Si2.chk.fmt" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Writing chk file │ filename = "/tmp/jl_SNIPYvq7QL" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading chk file │ filename = "/tmp/jl_SNIPYvq7QL" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/3fd6d3496ecb1c58334cff33e30998864ae16b66/reference/Si2.chk.fmt" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/3fd6d3496ecb1c58334cff33e30998864ae16b66/reference/Si2.chk" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Writing chk file │ filename = "/tmp/jl_kPOrobEJC3" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading chk file │ filename = "/tmp/jl_kPOrobEJC3" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/3fd6d3496ecb1c58334cff33e30998864ae16b66/reference/Si2.chk" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading amn file │ filename = "/home/pkgeval/.julia/artifacts/3fd6d3496ecb1c58334cff33e30998864ae16b66/reference/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/3fd6d3496ecb1c58334cff33e30998864ae16b66/reference/Si2.chk" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 ┌ Info: Reading amn file │ filename = "/home/pkgeval/.julia/artifacts/3fd6d3496ecb1c58334cff33e30998864ae16b66/reference/Si2.chk_U.amn" │ header = "Created by WannierIO.jl 2023-06-15T14:14:28.014" │ n_kpts = 729 │ n_bands = 16 └ n_wann = 8 Downloading artifact: Fe_soc ┌ Info: Reading chk file │ filename = "/home/pkgeval/.julia/artifacts/7408d03abce1b2a75fa2006fabc94a83499ee5ef/reference/Fe.chk" │ n_kpts = 125 │ n_bands = 22 └ n_wann = 16 ┌ Info: Writing chk file │ filename = "/tmp/jl_ORQxcduF87" │ n_kpts = 125 │ n_bands = 22 └ n_wann = 16 ┌ Info: Reading chk file │ filename = "/tmp/jl_ORQxcduF87" │ n_kpts = 125 │ n_bands = 22 └ n_wann = 16 ┌ Info: Reading eig file │ filename = "/home/pkgeval/.julia/artifacts/03635d409d4449351ac87b8069c763de898c03af/Si2_valence.eig" │ n_kpts = 216 └ n_bands = 4 ┌ Info: Writing eig file │ filename = "/tmp/jl_sRc9Gf2NMp" │ n_kpts = 216 └ n_bands = 4 ┌ Info: Reading eig file │ filename = "/tmp/jl_sRc9Gf2NMp" │ n_kpts = 216 └ n_bands = 4 ┌ Info: Reading eig file │ filename = "/home/pkgeval/.julia/artifacts/03635d409d4449351ac87b8069c763de898c03af/Si2_valence.eig" │ n_kpts = 216 └ n_bands = 4 ┌ Info: Reading eig file │ filename = "/home/pkgeval/.julia/artifacts/03635d409d4449351ac87b8069c763de898c03af/reference/binary/Si2_valence.eig" │ n_kpts = 216 └ n_bands = 4 ┌ Info: Writing eig file │ filename = "/tmp/jl_0R6BqbmTeR" │ n_kpts = 216 └ n_bands = 4 ┌ Info: Reading eig file │ filename = "/tmp/jl_0R6BqbmTeR" │ n_kpts = 216 └ n_bands = 4 Downloading artifact: CrI3 ┌ Info: Reading amn file │ filename = "/home/pkgeval/.julia/artifacts/03635d409d4449351ac87b8069c763de898c03af/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_InyFEHiZKB" │ header = "# Created by WannierIO.jl 2025-03-31T10:48:01.697" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading amn file │ filename = "/tmp/jl_InyFEHiZKB" │ header = "# Created by WannierIO.jl 2025-03-31T10:48:01.697" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading amn file │ filename = "/home/pkgeval/.julia/artifacts/03635d409d4449351ac87b8069c763de898c03af/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/03635d409d4449351ac87b8069c763de898c03af/reference/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_cDaVAJqzyT" │ header = "# Created by WannierIO.jl 2025-03-31T10:48:01.804" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading amn file │ filename = "/tmp/jl_cDaVAJqzyT" │ header = "# Created by WannierIO.jl 2025-03-31T10:48:01.804" │ n_kpts = 216 │ n_bands = 4 └ n_wann = 4 ┌ Info: Reading uHu file │ filename = "/home/pkgeval/.julia/artifacts/7408d03abce1b2a75fa2006fabc94a83499ee5ef/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_qD2piRst2p" │ header = "# Created by WannierIO.jl 2025-03-31T10:48:06.553" │ n_kpts = 8 │ n_bands = 4 └ n_bvecs = 12 ┌ Info: Reading uHu file │ filename = "/tmp/jl_qD2piRst2p" │ header = "# Created by WannierIO.jl 2025-03-31T10:48:06.553" │ n_kpts = 8 │ n_bvecs = 12 └ n_bands = 4 ┌ Info: Reading uHu file │ filename = "/home/pkgeval/.julia/artifacts/7408d03abce1b2a75fa2006fabc94a83499ee5ef/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/7408d03abce1b2a75fa2006fabc94a83499ee5ef/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_ED6T8FglUR" │ header = "# Created by WannierIO.jl 2025-03-31T10:48:09.452" │ n_kpts = 8 │ n_bands = 4 └ n_bvecs = 12 ┌ Info: Reading uHu file │ filename = "/tmp/jl_ED6T8FglUR" │ header = "# Created by WannierIO.jl 2025-03-31T10:48:09.452" │ n_kpts = 8 │ n_bvecs = 12 └ n_bands = 4 ┌ Info: Reading mmn file │ filename = "/home/pkgeval/.julia/artifacts/03635d409d4449351ac87b8069c763de898c03af/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_AFCRMpKb6b" │ header = "# Created by WannierIO.jl 2025-03-31T10:48:20.118" │ n_kpts = 216 │ n_bvecs = 8 └ n_bands = 4 ┌ Info: Reading mmn file │ filename = "/tmp/jl_AFCRMpKb6b" │ header = "# Created by WannierIO.jl 2025-03-31T10:48:20.118" │ n_kpts = 216 │ n_bvecs = 8 └ n_bands = 4 ┌ Info: Reading mmn file │ filename = "/home/pkgeval/.julia/artifacts/03635d409d4449351ac87b8069c763de898c03af/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/03635d409d4449351ac87b8069c763de898c03af/reference/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_yBmxWTKDyp" │ header = "# Created by WannierIO.jl 2025-03-31T10:48:24.772" │ n_kpts = 216 │ n_bvecs = 8 └ n_bands = 4 ┌ Info: Reading mmn file │ filename = "/tmp/jl_yBmxWTKDyp" │ header = "# Created by WannierIO.jl 2025-03-31T10:48:24.772" │ n_kpts = 216 │ n_bvecs = 8 └ n_bands = 4 ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/artifacts/03635d409d4449351ac87b8069c763de898c03af/Si2_valence.win" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (6, 6, 6) ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/artifacts/03635d409d4449351ac87b8069c763de898c03af/reference/Si2_valence.win.toml" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (6, 6, 6) read win: Test Failed at /home/pkgeval/.julia/packages/WannierIO/7p4om/test/w90/win.jl:11 Expression: win == test_data Evaluated: (wannier_plot_supercell = 4, num_bands = 4, num_iter = 4000, num_cg_steps = 200, conv_window = 3, write_hr = true, wannier_plot_format = "cube", num_wann = 4, conv_tol = 2.0e-10, use_ws_distance = true, wvfn_formatted = true, atoms_frac = Pair{Symbol, StaticArraysCore.SVector{3, Float64}}[:Si => [0.0, 0.0, 0.0], :Si => [0.25, 0.25, 0.25]], write_rmn = true, kpoints = StaticArraysCore.SVector{3, Float64}[[0.0, 0.0, 0.0], [0.0, 0.0, 0.16666667], [0.0, 0.0, 0.33333333], [0.0, 0.0, 0.5], [0.0, 0.0, 0.66666667], [0.0, 0.0, 0.83333333], [0.0, 0.16666667, 0.0], [0.0, 0.16666667, 0.16666667], [0.0, 0.16666667, 0.33333333], [0.0, 0.16666667, 0.5] … [0.83333333, 0.66666667, 0.33333333], [0.83333333, 0.66666667, 0.5], [0.83333333, 0.66666667, 0.66666667], [0.83333333, 0.66666667, 0.83333333], [0.83333333, 0.83333333, 0.0], [0.83333333, 0.83333333, 0.16666667], [0.83333333, 0.83333333, 0.33333333], [0.83333333, 0.83333333, 0.5], [0.83333333, 0.83333333, 0.66666667], [0.83333333, 0.83333333, 0.83333333]], mp_grid = [6, 6, 6], unit_cell_cart = [0.0 2.715265 2.715265; 2.715265 0.0 2.715265; 2.715265 2.715265 0.0], spn_formatted = true, kpoint_path = Vector{Pair{Symbol, StaticArraysCore.SVector{3, Float64}}}[[:G => [0.0, 0.0, 0.0], :X => [0.5, 0.0, 0.5]], [:X => [0.5, 0.0, 0.5], :U => [0.625, 0.25, 0.625]], [:U => [0.625, 0.25, 0.625], :K => [0.375, 0.375, 0.75]], [:K => [0.375, 0.375, 0.75], :G => [0.0, 0.0, 0.0]], [:G => [0.0, 0.0, 0.0], :L => [0.5, 0.5, 0.5]], [:L => [0.5, 0.5, 0.5], :W => [0.5, 0.25, 0.75]], [:W => [0.5, 0.25, 0.75], :X => [0.5, 0.0, 0.5]]], write_tb = true, projections = ["c= 0.67882,-0.67882,-0.67882:s", "c=-0.67882,-0.67882, 0.67882:s", "c=-0.67882, 0.67882,-0.67882:s", "c= 0.67882, 0.67882, 0.67882:s"], bands_plot = true, fermi_energy = 6.5283) == (wannier_plot_supercell = 4, num_bands = 4, num_iter = 4000, num_cg_steps = 200, conv_window = 3, write_hr = true, wannier_plot_format = "cube", num_wann = 4, conv_tol = 2.0e-10, use_ws_distance = true, wvfn_formatted = true, atoms_frac = Any[Dict{String, Any}("Si" => [0.0, 0.0, 0.0]), Dict{String, Any}("Si" => [0.25, 0.25, 0.25])], write_rmn = true, kpoints = StaticArraysCore.SVector{3, Float64}[[0.0, 0.0, 0.0], [0.0, 0.0, 0.16666667], [0.0, 0.0, 0.33333333], [0.0, 0.0, 0.5], [0.0, 0.0, 0.66666667], [0.0, 0.0, 0.83333333], [0.0, 0.16666667, 0.0], [0.0, 0.16666667, 0.16666667], [0.0, 0.16666667, 0.33333333], [0.0, 0.16666667, 0.5] … [0.83333333, 0.66666667, 0.33333333], [0.83333333, 0.66666667, 0.5], [0.83333333, 0.66666667, 0.66666667], [0.83333333, 0.66666667, 0.83333333], [0.83333333, 0.83333333, 0.0], [0.83333333, 0.83333333, 0.16666667], [0.83333333, 0.83333333, 0.33333333], [0.83333333, 0.83333333, 0.5], [0.83333333, 0.83333333, 0.66666667], [0.83333333, 0.83333333, 0.83333333]], mp_grid = [6, 6, 6], unit_cell_cart = [0.0 2.715265 2.715265; 2.715265 0.0 2.715265; 2.715265 2.715265 0.0], spn_formatted = true, kpoint_path = Any[Any[Dict{String, Any}("G" => [0.0, 0.0, 0.0]), Dict{String, Any}("X" => [0.5, 0.0, 0.5])], Any[Dict{String, Any}("X" => [0.5, 0.0, 0.5]), Dict{String, Any}("U" => [0.625, 0.25, 0.625])], Any[Dict{String, Any}("U" => [0.625, 0.25, 0.625]), Dict{String, Any}("K" => [0.375, 0.375, 0.75])], Any[Dict{String, Any}("K" => [0.375, 0.375, 0.75]), Dict{String, Any}("G" => [0.0, 0.0, 0.0])], Any[Dict{String, Any}("G" => [0.0, 0.0, 0.0]), Dict{String, Any}("L" => [0.5, 0.5, 0.5])], Any[Dict{String, Any}("L" => [0.5, 0.5, 0.5]), Dict{String, Any}("W" => [0.5, 0.25, 0.75])], Any[Dict{String, Any}("W" => [0.5, 0.25, 0.75]), Dict{String, Any}("X" => [0.5, 0.0, 0.5])]], write_tb = true, projections = ["c= 0.67882,-0.67882,-0.67882:s", "c=-0.67882,-0.67882, 0.67882:s", "c=-0.67882, 0.67882,-0.67882:s", "c= 0.67882, 0.67882, 0.67882:s"], bands_plot = true, fermi_energy = 6.5283) Stacktrace: [1] top-level scope @ ~/.julia/packages/WannierIO/7p4om/test/w90/win.jl:515 [2] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:679 [inlined] ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/artifacts/03635d409d4449351ac87b8069c763de898c03af/Si2_valence.win" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (6, 6, 6) ┌ Info: Writing win file │ filename = "/tmp/jl_wHWfobWBc5" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (6, 6, 6) ┌ Info: Reading win file │ filename = "/tmp/jl_wHWfobWBc5" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (6, 6, 6) ┌ Info: Reading win file │ filename = "/home/pkgeval/.julia/artifacts/03635d409d4449351ac87b8069c763de898c03af/reference/Si2_valence.win.toml" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (6, 6, 6) ┌ Info: Writing win file │ filename = "/tmp/jl_OFytAPKHG9" │ num_wann = 4 │ num_bands = 4 └ mp_grid = (6, 6, 6) ERROR: LoadError: BoundsError: attempt to access Dict{String, Any} with 1 entry at index [2] Stacktrace: [1] indexed_iterate(I::Dict{String, Any}, i::Int64, state::Int64) @ Base ./tuple.jl:171 [2] (::WannierIO.var"#39#40"{String, Vector{StaticArraysCore.SVector{3, Float64}}, Vector{Int64}, Vector{Any}, Vector{String}, Vector{Any}, StaticArraysCore.SMatrix{3, 3, Float64, 9}, Int64, Int64, Dict{Symbol, Any}})(io::IOStream) @ WannierIO ~/.julia/packages/WannierIO/7p4om/src/w90/win.jl:503 [3] open(::WannierIO.var"#39#40"{String, Vector{StaticArraysCore.SVector{3, Float64}}, Vector{Int64}, Vector{Any}, Vector{String}, Vector{Any}, StaticArraysCore.SMatrix{3, 3, Float64, 9}, Int64, Int64, Dict{Symbol, Any}}, ::String, ::Vararg{String}; kwargs::@Kwargs{}) @ Base ./io.jl:410 [4] open(::Function, ::String, ::String) @ Base ./io.jl:407 [5] write_win(filename::String, ::WannierIO.Wannier90Text; header::String, kwargs::@Kwargs{wannier_plot_supercell::Int64, num_bands::Int64, num_iter::Int64, num_cg_steps::Int64, conv_window::Int64, write_hr::Bool, wannier_plot_format::String, num_wann::Int64, conv_tol::Float64, use_ws_distance::Bool, wvfn_formatted::Bool, atoms_frac::Vector{Any}, write_rmn::Bool, kpoints::Vector{StaticArraysCore.SVector{3, Float64}}, mp_grid::Vector{Int64}, unit_cell_cart::StaticArraysCore.SMatrix{3, 3, Float64, 9}, spn_formatted::Bool, kpoint_path::Vector{Any}, write_tb::Bool, projections::Vector{String}, bands_plot::Bool, fermi_energy::Float64}) @ WannierIO ~/.julia/packages/WannierIO/7p4om/src/w90/win.jl:476 [6] write_win @ ~/.julia/packages/WannierIO/7p4om/src/w90/win.jl:457 [inlined] [7] write_win(filename::String; toml::Bool, kwargs::@Kwargs{wannier_plot_supercell::Int64, num_bands::Int64, num_iter::Int64, num_cg_steps::Int64, conv_window::Int64, write_hr::Bool, wannier_plot_format::String, num_wann::Int64, conv_tol::Float64, use_ws_distance::Bool, wvfn_formatted::Bool, atoms_frac::Vector{Any}, write_rmn::Bool, kpoints::Vector{StaticArraysCore.SVector{3, Float64}}, mp_grid::Vector{Int64}, unit_cell_cart::StaticArraysCore.SMatrix{3, 3, Float64, 9}, spn_formatted::Bool, kpoint_path::Vector{Any}, write_tb::Bool, projections::Vector{String}, bands_plot::Bool, fermi_energy::Float64}) @ WannierIO ~/.julia/packages/WannierIO/7p4om/src/w90/win.jl:568 [8] top-level scope @ ~/.julia/packages/WannierIO/7p4om/test/w90/win.jl:30 [9] eval(m::Module, e::Any) @ Core ./boot.jl:489 [10] include_string(mapexpr::typeof(identity), mod::Module, code::String, filename::String) @ Base ./loading.jl:2861 [11] include_string(m::Module, txt::String, fname::String) @ Base ./loading.jl:2871 [12] #run_testitem##0 @ ~/.julia/packages/TestItemRunner/uEMJE/src/TestItemRunner.jl:102 [inlined] [13] withpath(f::TestItemRunner.var"#run_testitem##0#run_testitem##1"{String, String, Module}, path::String) @ TestItemRunner ~/.julia/packages/TestItemRunner/uEMJE/src/vendored_code.jl:7 [14] run_testitem(filepath::String, use_default_usings::Bool, setups::Vector{Symbol}, package_name::String, original_code::String, line::Int64, column::Int64, test_setup_module_set::TestItemRunner.TestSetupModuleSet) @ TestItemRunner ~/.julia/packages/TestItemRunner/uEMJE/src/TestItemRunner.jl:101 [15] run_tests(path::String; filter::Nothing, verbose::Bool) @ TestItemRunner ~/.julia/packages/TestItemRunner/uEMJE/src/TestItemRunner.jl:185 [16] top-level scope @ ~/.julia/packages/WannierIO/7p4om/test/runtests.jl:10 [17] include(mapexpr::Function, mod::Module, _path::String) @ Base ./Base.jl:304 [18] top-level scope @ none:6 [19] eval(m::Module, e::Any) @ Core ./boot.jl:489 [20] exec_options(opts::Base.JLOptions) @ Base ./client.jl:294 [21] _start() @ Base ./client.jl:560 in expression starting at /home/pkgeval/.julia/packages/WannierIO/7p4om/test/w90/win.jl:30 in expression starting at /home/pkgeval/.julia/packages/WannierIO/7p4om/test/runtests.jl:10 Testing failed after 179.88s ERROR: LoadError: Package WannierIO errored during testing Stacktrace: [1] pkgerror(msg::String) @ Pkg.Types /opt/julia/share/julia/stdlib/v1.12/Pkg/src/Types.jl:68 [2] test(ctx::Pkg.Types.Context, pkgs::Vector{PackageSpec}; coverage::Bool, julia_args::Cmd, test_args::Cmd, test_fn::Nothing, force_latest_compatible_version::Bool, allow_earlier_backwards_compatible_versions::Bool, allow_reresolve::Bool) @ Pkg.Operations /opt/julia/share/julia/stdlib/v1.12/Pkg/src/Operations.jl:2365 [3] test @ /opt/julia/share/julia/stdlib/v1.12/Pkg/src/Operations.jl:2220 [inlined] [4] test(ctx::Pkg.Types.Context, pkgs::Vector{PackageSpec}; coverage::Bool, test_fn::Nothing, julia_args::Cmd, test_args::Cmd, force_latest_compatible_version::Bool, allow_earlier_backwards_compatible_versions::Bool, allow_reresolve::Bool, kwargs::@Kwargs{io::IOContext{IO}}) @ Pkg.API /opt/julia/share/julia/stdlib/v1.12/Pkg/src/API.jl:486 [5] test(pkgs::Vector{PackageSpec}; io::IOContext{IO}, kwargs::@Kwargs{julia_args::Cmd}) @ Pkg.API /opt/julia/share/julia/stdlib/v1.12/Pkg/src/API.jl:164 [6] test(pkgs::Vector{String}; kwargs::@Kwargs{julia_args::Cmd}) @ Pkg.API /opt/julia/share/julia/stdlib/v1.12/Pkg/src/API.jl:152 [7] test @ /opt/julia/share/julia/stdlib/v1.12/Pkg/src/API.jl:152 [inlined] [8] #test#81 @ /opt/julia/share/julia/stdlib/v1.12/Pkg/src/API.jl:151 [inlined] [9] top-level scope @ /PkgEval.jl/scripts/evaluate.jl:219 [10] include(mod::Module, _path::String) @ Base ./Base.jl:303 [11] exec_options(opts::Base.JLOptions) @ Base ./client.jl:328 [12] _start() @ Base ./client.jl:560 in expression starting at /PkgEval.jl/scripts/evaluate.jl:210 PkgEval failed after 342.81s: package tests unexpectedly errored