Package evaluation to test GeometryOptimization on Julia 1.14.0-DEV.1877 (00654c1407*) started at 2026-03-10T17:26:53.682 ################################################################################ # Set-up # Installing PkgEval dependencies (TestEnv)... Activating project at `~/.julia/environments/v1.14` Set-up completed after 14.33s ################################################################################ # Installation # Installing GeometryOptimization... Resolving package versions... Updating `~/.julia/environments/v1.14/Project.toml` [673bf261] + GeometryOptimization v0.1.5 Updating `~/.julia/environments/v1.14/Manifest.toml` [47edcb42] + ADTypes v1.21.0 [79e6a3ab] + Adapt v4.5.0 [66dad0bd] + AliasTables v1.1.3 [4fba245c] + ArrayInterface v7.23.0 [a963bdd2] + AtomsBase v0.5.2 [a3e0e189] + AtomsCalculators v0.2.3 [bbf7d656] + CommonSubexpressions v0.3.1 [34da2185] + Compat v4.18.1 [187b0558] + ConstructionBase v1.6.0 [a8cc5b0e] + Crayons v4.1.1 [9a962f9c] + DataAPI v1.16.0 [864edb3b] + DataStructures v0.19.3 [e2d170a0] + DataValueInterfaces v1.0.0 [163ba53b] + DiffResults v1.1.0 [b552c78f] + DiffRules v1.15.1 [a0c0ee7d] + DifferentiationInterface v0.7.16 [ffbed154] + DocStringExtensions v0.9.5 [4e289a0a] + EnumX v1.0.7 [e2ba6199] + ExprTools v0.1.10 [1a297f60] + FillArrays v1.16.0 [6a86dc24] + FiniteDiff v2.29.0 [f6369f11] + ForwardDiff v1.3.2 [673bf261] + GeometryOptimization v0.1.5 [92d709cd] + IrrationalConstants v0.2.6 [82899510] + IteratorInterfaceExtensions v1.0.0 [692b3bcd] + JLLWrappers v1.7.1 [b964fa9f] + LaTeXStrings v1.4.0 ⌃ [d3d80556] + LineSearches v7.5.1 [2ab3a3ac] + LogExpFunctions v0.3.29 [1914dd2f] + MacroTools v0.5.16 [e1d29d7a] + Missings v1.2.0 ⌅ [d41bc354] + NLSolversBase v7.10.0 [77ba4419] + NaNMath v1.1.3 ⌅ [429524aa] + Optim v1.13.3 [bac558e1] + OrderedCollections v1.8.1 [7b2266bf] + PeriodicTable v1.2.1 [85a6dd25] + PositiveFactorizations v0.2.4 [aea7be01] + PrecompileTools v1.3.3 [21216c6a] + Preferences v1.5.2 [08abe8d2] + PrettyTables v3.2.3 [43287f4e] + PtrArrays v1.4.0 [189a3867] + Reexport v1.2.2 [ae029012] + Requires v1.3.1 [efcf1570] + Setfield v1.1.2 [a2af1166] + SortingAlgorithms v1.2.2 [276daf66] + SpecialFunctions v2.7.1 [90137ffa] + StaticArrays v1.9.17 [1e83bf80] + StaticArraysCore v1.4.4 [10745b16] + Statistics v1.11.1 [82ae8749] + StatsAPI v1.8.0 [2913bbd2] + StatsBase v0.34.10 [892a3eda] + StringManipulation v0.4.4 [3783bdb8] + TableTraits v1.0.1 [bd369af6] + Tables v1.12.1 [a759f4b9] + TimerOutputs v0.5.29 [1986cc42] + Unitful v1.28.0 [a7773ee8] + UnitfulAtomic v1.0.0 [efe28fd5] + OpenSpecFun_jll v0.5.6+0 [56f22d72] + Artifacts v1.11.0 [2a0f44e3] + Base64 v1.11.0 [ade2ca70] + Dates v1.11.0 [8ba89e20] + Distributed v1.11.0 [7b1f6079] + FileWatching v1.11.0 [9fa8497b] + Future v1.11.0 [b77e0a4c] + InteractiveUtils v1.11.0 [ac6e5ff7] + JuliaSyntaxHighlighting v1.13.0 [8f399da3] + Libdl v1.11.0 [37e2e46d] + LinearAlgebra v1.13.0 [56ddb016] + Logging v1.11.0 [d6f4376e] + Markdown v1.11.0 [de0858da] + Printf v1.11.0 [3fa0cd96] + REPL v1.11.0 [9a3f8284] + Random v1.11.0 [ea8e919c] + SHA v1.0.0 [9e88b42a] + Serialization v1.11.0 [6462fe0b] + Sockets v1.11.0 [2f01184e] + SparseArrays v1.13.0 [f489334b] + StyledStrings v1.13.0 [fa267f1f] + TOML v1.0.3 [8dfed614] + Test v1.11.0 [cf7118a7] + UUIDs v1.11.0 [4ec0a83e] + Unicode v1.11.0 [e66e0078] + CompilerSupportLibraries_jll v1.3.0+1 [4536629a] + OpenBLAS_jll v0.3.30+0 [05823500] + OpenLibm_jll v0.8.7+0 [bea87d4a] + SuiteSparse_jll v7.10.1+0 [8e850b90] + libblastrampoline_jll v5.15.0+0 Info Packages marked with ⌃ and ⌅ have new versions available. Those with ⌃ may be upgradable, but those with ⌅ are restricted by compatibility constraints from upgrading. To see why use `status --outdated -m` Installation completed after 6.16s ################################################################################ # Precompilation # Precompiling PkgEval dependencies... Precompiling package dependencies... Precompiling packages... 2463.5 ms ✓ Chemfiles_jll 6764.5 ms ✓ XCrySDenStructureFormat 5265.9 ms ✓ NeighbourLists 4079.6 ms ✓ PubChemCrawler 7576.7 ms ✓ OptimizationBase 12347.6 ms ✓ GeometryOptimization 7756.1 ms ✓ Chemfiles 11761.1 ms ✓ AtomsCalculatorsUtilities 1757.2 ms ✓ OptimizationBase → OptimizationForwardDiffExt 7035.6 ms ✓ Optimization 4713.8 ms ✓ AtomsIO 8500.2 ms ✓ EmpiricalPotentials 6821.2 ms ✓ OptimizationNLopt 12196.0 ms ✓ GeometryOptimization → GeometryOptimizationOptimizationExt 10884.0 ms ✓ AtomsBuilder 15 dependencies successfully precompiled in 115 seconds. 227 already precompiled. Precompilation completed after 135.75s ################################################################################ # Testing # Testing GeometryOptimization Status `/tmp/jl_35EVEr/Project.toml` [a963bdd2] AtomsBase v0.5.2 [f5cc8831] AtomsBuilder v0.2.3 [a3e0e189] AtomsCalculators v0.2.3 [ffbed154] DocStringExtensions v0.9.5 [38527215] EmpiricalPotentials v0.2.5 [673bf261] GeometryOptimization v0.1.5 ⌃ [d3d80556] LineSearches v7.5.1 ⌅ [429524aa] Optim v1.13.3 ⌅ [7f7a1694] Optimization v4.8.0 ⌃ [4e6fcdb7] OptimizationNLopt v0.3.4 [08abe8d2] PrettyTables v3.2.3 [90137ffa] StaticArrays v1.9.17 [f8b46487] TestItemRunner v1.1.4 [a759f4b9] TimerOutputs v0.5.29 [1986cc42] Unitful v1.28.0 [a7773ee8] UnitfulAtomic v1.0.0 [37e2e46d] LinearAlgebra v1.13.0 [de0858da] Printf v1.11.0 [8dfed614] Test v1.11.0 Status `/tmp/jl_35EVEr/Manifest.toml` [47edcb42] ADTypes v1.21.0 [1520ce14] AbstractTrees v0.4.5 [7d9f7c33] Accessors v0.1.43 [79e6a3ab] Adapt v4.5.0 [66dad0bd] AliasTables v1.1.3 [dce04be8] ArgCheck v2.5.0 [4fba245c] ArrayInterface v7.23.0 [a963bdd2] AtomsBase v0.5.2 [f5cc8831] AtomsBuilder v0.2.3 [a3e0e189] AtomsCalculators v0.2.3 [9855a07e] AtomsCalculatorsUtilities v0.1.8 [1692102d] AtomsIO v0.3.1 [198e06fe] BangBang v0.4.8 [9718e550] Baselet v0.1.1 [d1d4a3ce] BitFlags v0.1.9 [8ce10254] Bumper v0.7.1 [fa961155] CEnum v0.5.0 [46823bd8] Chemfiles v0.10.43 [ae650224] ChunkSplitters v3.2.0 [944b1d66] CodecZlib v0.7.8 [38540f10] CommonSolve v0.2.6 [bbf7d656] CommonSubexpressions v0.3.1 [34da2185] Compat v4.18.1 [a33af91c] CompositionsBase v0.1.2 [f0e56b4a] ConcurrentUtilities v2.5.1 [88cd18e8] ConsoleProgressMonitor v0.1.2 [187b0558] ConstructionBase v1.6.0 [a8cc5b0e] Crayons v4.1.1 [9a962f9c] DataAPI v1.16.0 [864edb3b] DataStructures v0.19.3 [e2d170a0] DataValueInterfaces v1.0.0 [244e2a9f] DefineSingletons v0.1.2 [163ba53b] DiffResults v1.1.0 [b552c78f] DiffRules v1.15.1 [a0c0ee7d] DifferentiationInterface v0.7.16 [ffbed154] DocStringExtensions v0.9.5 [38527215] EmpiricalPotentials v0.2.5 [4e289a0a] EnumX v1.0.7 [460bff9d] ExceptionUnwrapping v0.1.11 [e2ba6199] ExprTools v0.1.10 [55351af7] ExproniconLite v0.10.14 [352459e4] ExtXYZ v0.2.2 [e189563c] ExternalDocstrings v0.1.1 [9aa1b823] FastClosures v0.3.2 [1a297f60] FillArrays v1.16.0 [6a86dc24] FiniteDiff v2.29.0 [41a02a25] Folds v0.2.10 [f6369f11] ForwardDiff v1.3.2 [069b7b12] FunctionWrappers v1.1.3 [77dc65aa] FunctionWrappersWrappers v0.1.3 [46192b85] GPUArraysCore v0.2.0 [673bf261] GeometryOptimization v0.1.5 [cd3eb016] HTTP v1.10.19 [22cec73e] InitialValues v0.3.1 [3587e190] InverseFunctions v0.1.17 [92d709cd] IrrationalConstants v0.2.6 [82899510] IteratorInterfaceExtensions v1.0.0 [692b3bcd] JLLWrappers v1.7.1 [682c06a0] JSON v1.4.0 [ae98c720] Jieko v0.2.1 [5be7bae1] LBFGSB v0.4.1 [b964fa9f] LaTeXStrings v1.4.0 [1d6d02ad] LeftChildRightSiblingTrees v0.2.1 [9c8b4983] LightXML v0.9.3 ⌃ [d3d80556] LineSearches v7.5.1 [2ab3a3ac] LogExpFunctions v0.3.29 [e6f89c97] LoggingExtras v1.2.0 [1914dd2f] MacroTools v0.5.16 [739be429] MbedTLS v1.1.10 [128add7d] MicroCollections v0.2.0 [e1d29d7a] Missings v1.2.0 [2e0e35c7] Moshi v0.3.7 ⌅ [d41bc354] NLSolversBase v7.10.0 [76087f3c] NLopt v1.2.1 [77ba4419] NaNMath v1.1.3 ⌅ [2fcf5ba9] NeighbourLists v0.5.10 [4d8831e6] OpenSSL v1.6.1 ⌅ [429524aa] Optim v1.13.3 ⌅ [7f7a1694] Optimization v4.8.0 ⌅ [bca83a33] OptimizationBase v2.14.0 ⌃ [4e6fcdb7] OptimizationNLopt v0.3.4 [bac558e1] OrderedCollections v1.8.1 [90014a1f] PDMats v0.11.37 [69de0a69] Parsers v2.8.3 [7b2266bf] PeriodicTable v1.2.1 [85a6dd25] PositiveFactorizations v0.2.4 [d236fae5] PreallocationTools v1.1.2 [aea7be01] PrecompileTools v1.3.3 [21216c6a] Preferences v1.5.2 [08abe8d2] PrettyTables v3.2.3 [33c8b6b6] ProgressLogging v0.1.6 [92933f4c] ProgressMeter v1.11.0 [43287f4e] PtrArrays v1.4.0 [30e472fa] PubChemCrawler v1.4.0 [3cdcf5f2] RecipesBase v1.3.4 [731186ca] RecursiveArrayTools v3.48.0 [189a3867] Reexport v1.2.2 [42d2dcc6] Referenceables v0.1.3 [ae029012] Requires 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[de0858da] Printf v1.11.0 [3fa0cd96] REPL v1.11.0 [9a3f8284] Random v1.11.0 [ea8e919c] SHA v1.0.0 [9e88b42a] Serialization v1.11.0 [6462fe0b] Sockets v1.11.0 [2f01184e] SparseArrays v1.13.0 [f489334b] StyledStrings v1.13.0 [4607b0f0] SuiteSparse [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 v8.18.0+1 [e37daf67] LibGit2_jll v1.9.2+0 [29816b5a] LibSSH2_jll v1.11.3+1 [14a3606d] MozillaCACerts_jll v2025.12.2 [4536629a] OpenBLAS_jll v0.3.30+0 [05823500] OpenLibm_jll v0.8.7+0 [458c3c95] OpenSSL_jll v3.5.5+0 [efcefdf7] PCRE2_jll v10.47.0+0 [bea87d4a] SuiteSparse_jll v7.10.1+0 [83775a58] Zlib_jll v1.3.2+0 [3161d3a3] Zstd_jll v1.5.7+1 [8e850b90] libblastrampoline_jll v5.15.0+0 [8e850ede] nghttp2_jll v1.68.0+1 [3f19e933] p7zip_jll v17.7.0+0 Info Packages marked with ⌃ and ⌅ have new versions available. Those with ⌃ may be upgradable, but those with ⌅ are restricted by compatibility constraints from upgrading. Testing Running tests... ┌ Warning: The selected optimization algorithm requires second order derivatives, but `SecondOrder` ADtype was not provided. │ So a `SecondOrder` with SciMLBase.NoAD() for both inner and outer will be created, this can be suboptimal and not work in some cases so │ an explicit `SecondOrder` ADtype is recommended. └ @ OptimizationBase ~/.julia/packages/OptimizationBase/ivotG/src/cache.jl:49 ┌ Warning: Geometry optimisation not converged. └ @ GeometryOptimization ~/.julia/packages/GeometryOptimization/Jzd7V/src/minimize_energy.jl:184 Geometry optimisation convergence (in atomic units) ┌─────┬─────────────────┬───────────┬─────────────┬────────┐ │ n │ Energy │ log10(ΔE) │ max(Force) │ Δtime │ ├─────┼─────────────────┼───────────┼─────────────┼────────┤ │ 0 │ -1.244793590597 │ │ 0.0623474 │ 11.1ms │ │ 1 │ -1.271187818397 │ │ 0.0202268 │ 17.3s │ │ 2 │ -1.273917637767 │ -2.56 │ 0.00422913 │ 119ms │ │ 3 │ -1.274216910497 │ -3.52 │ 0.0036639 │ 16.8ms │ │ 4 │ -1.274447073031 │ -3.64 │ 0.00181711 │ 2.16ms │ │ 5 │ -1.274465014809 │ -4.75 │ 0.000330806 │ 2.29ms │ │ 6 │ -1.274465966526 │ -6.02 │ 4.26781e-5 │ 2.16ms │ │ 7 │ -1.274465978211 │ -7.93 │ 8.7182e-6 │ 2.39ms │ │ 8 │ -1.274465979278 │ -8.97 │ 6.31892e-6 │ 2.26ms │ │ 9 │ -1.274465980056 │ -9.11 │ 3.43008e-6 │ 2.29ms │ │ 10 │ -1.274465980161 │ -9.98 │ 1.12358e-6 │ 2.13ms │ │ 11 │ -1.274465980168 │ -11.12 │ 9.4088e-8 │ 2.06ms │ │ 12 │ -1.274465980169 │ -13.32 │ 2.44012e-8 │ 2.04ms │ │ 13 │ -1.274465980169 │ -14.20 │ 1.03568e-8 │ 2.08ms │ │ 14 │ -1.274465980169 │ + -Inf │ 1.00135e-8 │ 2.15ms │ │ 15 │ -1.274465980169 │ + -Inf │ 9.93621e-9 │ 2.04ms │ ┌ Warning: Geometry optimisation not converged. └ @ GeometryOptimization ~/.julia/packages/GeometryOptimization/Jzd7V/src/minimize_energy.jl:184 Geometry optimisation convergence (in atomic units) ┌─────┬─────────────────┬───────────┬─────────────┬─────────────┬──────────┬──── │ n │ Energy │ log10(ΔE) │ max(Force) │ max(Virial) │ Pressure │ ⋯ ├─────┼─────────────────┼───────────┼─────────────┼─────────────┼──────────┼──── │ 0 │ -5.056372501595 │ │ 0.0552503 │ 0.0789211 │ -0.021 │ 4 ⋯ 1 column omitted │ 1 │ -5.062376334819 │ │ 0.0394437 │ 0.228088 │ 0.094 │ ⋯ 1 column omitted │ 2 │ -5.090909123838 │ -1.54 │ 0.00976875 │ 0.285029 │ -0.27 │ 7 ⋯ 1 column omitted │ 3 │ -5.093902559155 │ -2.52 │ 0.0115917 │ 0.0246871 │ 0.0011 │ 7 ⋯ 1 column omitted │ 4 │ -5.094258914637 │ -3.45 │ 0.00966948 │ 0.0514726 │ 0.012 │ 6 ⋯ 1 column omitted │ 5 │ -5.094995909092 │ -3.13 │ 0.00766792 │ 0.108347 │ -0.028 │ 7 ⋯ 1 column omitted │ 6 │ -5.095986314357 │ -3.00 │ 0.00427991 │ 0.113549 │ 0.091 │ 6 ⋯ 1 column omitted │ 7 │ -5.096688975037 │ -3.15 │ 0.00636395 │ 0.00454578 │ -0.0011 │ 6 ⋯ 1 column omitted │ 8 │ -5.096885925059 │ -3.71 │ 0.00517995 │ 0.0591065 │ -0.007 │ 7 ⋯ 1 column omitted │ 9 │ -5.097509208601 │ -3.21 │ 0.00254172 │ 0.0178256 │ 0.017 │ 7 ⋯ 1 column omitted │ 10 │ -5.097527201595 │ -4.74 │ 0.00254197 │ 0.00706029 │ -0.0059 │ 7 ⋯ 1 column omitted │ 11 │ -5.097715088206 │ -3.73 │ 0.00155653 │ 0.0229141 │ 0.0013 │ 6 ⋯ 1 column omitted │ 12 │ -5.097776844712 │ -4.21 │ 0.00101148 │ 0.0156581 │ 0.001 │ 7 ⋯ 1 column omitted │ 13 │ -5.097797576242 │ -4.68 │ 0.00115135 │ 0.00415072 │ -0.0032 │ 6 ⋯ 1 column omitted │ 14 │ -5.097799269007 │ -5.77 │ 0.00112734 │ 0.00469382 │ 0.0036 │ 6 ⋯ 1 column omitted │ 15 │ -5.097826252891 │ -4.57 │ 0.000696845 │ 0.00817683 │ -0.0018 │ 7 ⋯ 1 column omitted │ 16 │ -5.097833795656 │ -5.12 │ 0.000898163 │ 0.000422323 │ -0.00011 │ 6 ⋯ 1 column omitted │ 17 │ -5.097842436517 │ -5.06 │ 0.00044165 │ 0.00962888 │ 0.0069 │ 7 ⋯ 1 column omitted │ 18 │ -5.097848018738 │ -5.25 │ 0.00029336 │ 0.00849971 │ -0.0027 │ 6 ⋯ 1 column omitted │ 19 │ -5.097851061488 │ -5.52 │ 0.000360537 │ 0.00318567 │ 0.0013 │ 7 ⋯ 1 column omitted │ 20 │ -5.097852059616 │ -6.00 │ 0.000367527 │ 0.00066802 │ -6.3e-5 │ 7 ⋯ 1 column omitted │ 21 │ -5.097858691809 │ -5.18 │ 0.000325289 │ 0.00363898 │ -0.0034 │ 7 ⋯ 1 column omitted │ 22 │ -5.097860031960 │ -5.87 │ 0.000366154 │ 0.00189068 │ 0.0016 │ 7 ⋯ 1 column omitted │ 23 │ -5.097860285222 │ -6.60 │ 0.000362339 │ 0.00126584 │ -0.0011 │ 6 ⋯ 1 column omitted │ 24 │ -5.097862567404 │ -5.64 │ 0.000223326 │ 0.00292359 │ -0.00089 │ 6 ⋯ 1 column omitted │ 25 │ -5.097863968147 │ -5.85 │ 0.000144611 │ 0.00406633 │ 0.0015 │ 6 ⋯ 1 column omitted │ 26 │ -5.097864574292 │ -6.22 │ 0.000161877 │ 0.00223048 │ -0.0015 │ 6 ⋯ 1 column omitted │ 27 │ -5.097864827275 │ -6.60 │ 0.000181774 │ 0.00023657 │ -3.5e-5 │ 7 ⋯ 1 column omitted │ 28 │ -5.097864980440 │ -6.81 │ 0.000137883 │ 0.00147943 │ 0.0013 │ 6 ⋯ 1 column omitted │ 29 │ -5.097865457136 │ -6.32 │ 6.93164e-5 │ 0.00099771 │ -0.00093 │ 6 ⋯ 1 column omitted │ 30 │ -5.097865572597 │ -6.94 │ 7.32149e-5 │ 8.78159e-5 │ -6.0e-5 │ 7 ⋯ 1 column omitted │ 31 │ -5.097865594642 │ -7.66 │ 6.54618e-5 │ 0.000631754 │ 0.00061 │ 7 ⋯ 1 column omitted │ 32 │ -5.097865750963 │ -6.81 │ 5.32997e-5 │ 0.000906021 │ -0.00041 │ 7 ⋯ 1 column 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-Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 100 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 101 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 102 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 103 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 104 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 105 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 106 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 107 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 108 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 109 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 110 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 111 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 112 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 113 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 114 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 115 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 116 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 117 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 118 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 119 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 120 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 121 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 122 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 123 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 124 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 125 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 126 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 127 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 128 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 129 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 130 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 9 ⋯ 1 column omitted │ 131 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 9 ⋯ 1 column omitted │ 132 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 9 ⋯ 1 column omitted │ 133 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 134 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 135 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 136 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 137 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 138 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 139 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 140 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 141 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 142 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 143 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 144 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 145 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 9 ⋯ 1 column omitted │ 146 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 147 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 148 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 149 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 150 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 9 ⋯ 1 column omitted │ 151 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 8 ⋯ 1 column omitted │ 152 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 9 ⋯ 1 column omitted │ 153 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 7 ⋯ 1 column omitted │ 154 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 7 ⋯ 1 column omitted │ 155 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 7 ⋯ 1 column omitted │ 156 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 7 ⋯ 1 column omitted │ 157 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 7 ⋯ 1 column omitted │ 158 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 7 ⋯ 1 column omitted │ 159 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 7 ⋯ 1 column omitted │ 160 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 8 ⋯ 1 column omitted │ 161 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 8 ⋯ 1 column omitted │ 162 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 7 ⋯ 1 column omitted │ 163 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 7 ⋯ 1 column omitted │ 164 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 9 ⋯ 1 column omitted │ 165 │ -5.097865972090 │ + -Inf │ 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│ ⋯ 1 column omitted │ 232 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 233 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 234 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 235 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 236 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 237 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 238 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 239 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 240 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 241 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 242 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 243 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 244 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 245 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 246 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 247 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 248 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 249 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 250 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 251 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 252 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 253 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column 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265 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 266 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 267 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 268 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 269 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 270 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 271 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 272 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 273 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 274 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 275 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 276 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 277 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 278 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 279 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 280 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 281 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 282 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 283 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 284 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 285 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 286 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 287 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 288 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 289 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 290 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 291 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 292 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 293 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 294 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 295 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 296 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 297 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 298 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 299 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 300 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 301 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 302 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 303 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 304 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 305 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 306 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 307 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 9 ⋯ 1 column omitted │ 308 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 309 │ 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-5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ 9 ⋯ 1 column omitted │ 376 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 377 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 378 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 379 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 380 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 381 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 382 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 383 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 384 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 385 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 386 │ 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-5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 398 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 399 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 400 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 401 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 402 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 403 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 404 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 405 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 406 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 407 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 408 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 409 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 410 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 411 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 412 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 413 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 414 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 415 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 416 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 417 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 418 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 419 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 420 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 421 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 422 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 423 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 424 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 425 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 426 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 427 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 428 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 429 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 430 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 431 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 432 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 433 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 434 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 435 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 436 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 437 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 438 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 439 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 440 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 441 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 442 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 443 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 444 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 445 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 446 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 447 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 448 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 449 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 450 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 451 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 452 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 453 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 454 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 455 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 456 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 457 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 458 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 459 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 460 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 461 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 462 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 463 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 464 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 465 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 466 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 467 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 468 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 469 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 470 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 471 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 472 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 473 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 474 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 475 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 476 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 477 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 478 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 479 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 480 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 481 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 482 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 483 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 484 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 485 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 486 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 487 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 488 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 489 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 490 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 491 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 492 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 493 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 494 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 495 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 496 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 497 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 498 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 499 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted │ 500 │ -5.097865972090 │ + -Inf │ 1.02413e-7 │ 2.06157e-7 │ -5.0e-8 │ ⋯ 1 column omitted ┌ Warning: Geometry optimisation not converged. └ @ GeometryOptimization ~/.julia/packages/GeometryOptimization/Jzd7V/src/minimize_energy.jl:184 ┌ Warning: Geometry optimisation not converged. └ @ GeometryOptimization ~/.julia/packages/GeometryOptimization/Jzd7V/src/minimize_energy.jl:184 ┌ Warning: Geometry optimisation not converged. └ @ GeometryOptimization ~/.julia/packages/GeometryOptimization/Jzd7V/src/minimize_energy.jl:184 Test Summary: | Pass Total Time Package | 76 76 2m30.6s test/dofmgr.jl | 18 18 1m18.5s DofManager | 18 18 1m18.5s Fixed cell getter / setter (no clamped) | 4 4 14.2s Variable cell getter / setter (no clamped) | 6 6 2.4s eval_objective / eval_gradient agrees with raw energy | 8 8 28.9s test/nlopt.jl | 2 2 31.6s Test NLopt solver via Optimization.jl interface | 2 2 31.6s test/minimization.jl | 48 48 33.7s Test silicon StillingerWeber fixed cell minimisation | 36 36 27.5s Test silicon StillingerWeber variable cell minimisation | 12 12 6.2s test/calculator_interface.jl | 8 8 6.7s Test GeometryOptimization with AtomsCalculators interface | 8 8 6.7s minimize_energy! with fixed cell | 4 4 3.2s minimize_energy! with variable cell | 4 4 0.9s Testing GeometryOptimization tests passed Testing completed after 212.2s PkgEval succeeded after 387.86s