Package evaluation of InteratomicPotentials on Julia 1.12.0-DEV.2153 (83dcbd426d*) started at 2025-03-31T10:42:45.506 ################################################################################ # Set-up # Installing PkgEval dependencies (TestEnv)... Set-up completed after 9.58s ################################################################################ # Installation # Installing InteratomicPotentials... Resolving package versions... Installed StatsAPI ────────────── v1.7.0 Installed Requires ────────────── v1.3.1 Installed Distances ───────────── v0.10.12 Installed StaticArrays ────────── v1.9.13 Installed Preferences ─────────── v1.4.3 Installed Unitful ─────────────── v1.22.0 Installed AtomsBase ───────────── v0.3.5 Installed StaticArraysCore ────── v1.4.3 Installed PeriodicTable ───────── v1.2.1 Installed Statistics ──────────── v1.11.1 Installed PrecompileTools ─────── v1.3.0 Installed UnitfulAtomic ───────── v1.0.0 Installed InteratomicPotentials ─ v0.2.6 Installed NearestNeighbors ────── v0.4.21 Updating `~/.julia/environments/v1.12/Project.toml` [a9efe35a] + InteratomicPotentials v0.2.6 Updating `~/.julia/environments/v1.12/Manifest.toml` ⌅ [a963bdd2] + AtomsBase v0.3.5 [b4f34e82] + Distances v0.10.12 [a9efe35a] + InteratomicPotentials v0.2.6 [b8a86587] + NearestNeighbors v0.4.21 [7b2266bf] + PeriodicTable v1.2.1 [aea7be01] + PrecompileTools v1.3.0 [21216c6a] + Preferences v1.4.3 [ae029012] + Requires v1.3.1 [90137ffa] + StaticArrays v1.9.13 [1e83bf80] + StaticArraysCore v1.4.3 [10745b16] + Statistics v1.11.1 [82ae8749] + StatsAPI v1.7.0 [1986cc42] + Unitful v1.22.0 [a7773ee8] + UnitfulAtomic v1.0.0 [56f22d72] + Artifacts v1.11.0 [2a0f44e3] + Base64 v1.11.0 [ade2ca70] + Dates v1.11.0 [8f399da3] + Libdl v1.11.0 [37e2e46d] + LinearAlgebra v1.12.0 [de0858da] + Printf v1.11.0 [9a3f8284] + Random v1.11.0 [ea8e919c] + SHA v0.7.0 [fa267f1f] + TOML v1.0.3 [cf7118a7] + UUIDs v1.11.0 [4ec0a83e] + Unicode v1.11.0 [e66e0078] + CompilerSupportLibraries_jll v1.3.0+1 [4536629a] + OpenBLAS_jll v0.3.29+0 [8e850b90] + libblastrampoline_jll v5.12.0+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 To see why use `status --outdated -m` Installation completed after 4.91s ################################################################################ # Precompilation # Precompiling PkgEval dependencies... Precompiling packages... 6907.4 ms ✓ TestEnv 1 dependency successfully precompiled in 9 seconds. 25 already precompiled. Precompiling package dependencies... Precompilation completed after 128.77s ################################################################################ # Testing # Testing InteratomicPotentials Status `/tmp/jl_2kqSPO/Project.toml` ⌅ [a963bdd2] AtomsBase v0.3.5 [a9efe35a] InteratomicPotentials v0.2.6 [90137ffa] StaticArrays v1.9.13 [1986cc42] Unitful v1.22.0 [a7773ee8] UnitfulAtomic v1.0.0 [37e2e46d] LinearAlgebra v1.12.0 [8dfed614] Test v1.11.0 Status `/tmp/jl_2kqSPO/Manifest.toml` ⌅ [a963bdd2] AtomsBase v0.3.5 [b4f34e82] Distances v0.10.12 [a9efe35a] InteratomicPotentials v0.2.6 [b8a86587] NearestNeighbors v0.4.21 [7b2266bf] PeriodicTable v1.2.1 [aea7be01] PrecompileTools v1.3.0 [21216c6a] Preferences v1.4.3 [ae029012] Requires v1.3.1 [90137ffa] StaticArrays v1.9.13 [1e83bf80] StaticArraysCore v1.4.3 [10745b16] Statistics v1.11.1 [82ae8749] StatsAPI v1.7.0 [1986cc42] Unitful v1.22.0 [a7773ee8] UnitfulAtomic v1.0.0 [56f22d72] Artifacts v1.11.0 [2a0f44e3] Base64 v1.11.0 [ade2ca70] Dates v1.11.0 [b77e0a4c] InteractiveUtils v1.11.0 [ac6e5ff7] JuliaSyntaxHighlighting v1.12.0 [8f399da3] Libdl v1.11.0 [37e2e46d] LinearAlgebra v1.12.0 [56ddb016] Logging v1.11.0 [d6f4376e] Markdown v1.11.0 [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 [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 v0.3.29+0 [8e850b90] libblastrampoline_jll v5.12.0+0 Info Packages marked with ⌅ have new versions available but compatibility constraints restrict them from upgrading. Testing Running tests... Empirical Potential Default Implmentation Unit Tests: Error During Test at /home/pkgeval/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:16 Test threw exception Expression: energy_and_force(system, p) isa NamedTuple{(:e, :f), <:Tuple{<:Unitful.Energy, <:AbstractVector{<:SVector{3, <:Unitful.Force}}}} TaskFailedException nested task error: BoundsError: attempt to access 1-element Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}} at index [2] Stacktrace: [1] throw_boundserror(A::Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, I::Tuple{Int64}) @ Base ./essentials.jl:15 [2] getindex @ ./essentials.jl:917 [inlined] [3] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:39 [inlined] [4] (::InteratomicPotentials.var"#_perform_pairwise##6#_perform_pairwise##7"{InteratomicPotentials.var"#_perform_pairwise##8#_perform_pairwise##9"{InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{MockEmpiricalPotential}, MockEmpiricalPotential, Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, Vector{Symbol}, NeighborList, UnitRange{Int64}}})(tid::Int64; onethread::Bool) @ InteratomicPotentials ./threadingconstructs.jl:276 [5] #_perform_pairwise##6 @ ./threadingconstructs.jl:243 [inlined] [6] (::Base.Threads.var"#threading_run##0#threading_run##1"{InteratomicPotentials.var"#_perform_pairwise##6#_perform_pairwise##7"{InteratomicPotentials.var"#_perform_pairwise##8#_perform_pairwise##9"{InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{MockEmpiricalPotential}, MockEmpiricalPotential, Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, Vector{Symbol}, NeighborList, UnitRange{Int64}}}, Int64})() @ Base.Threads ./threadingconstructs.jl:177 Stacktrace: [1] threading_run(fun::InteratomicPotentials.var"#_perform_pairwise##6#_perform_pairwise##7"{InteratomicPotentials.var"#_perform_pairwise##8#_perform_pairwise##9"{InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{MockEmpiricalPotential}, MockEmpiricalPotential, Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, Vector{Symbol}, NeighborList, UnitRange{Int64}}}, static::Bool) @ Base.Threads ./threadingconstructs.jl:196 [2] macro expansion @ ./threadingconstructs.jl:213 [inlined] [3] _perform_pairwise(f::InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{MockEmpiricalPotential}, s::FlexibleSystem{3, Atom{3, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}, Quantity{Float64, 𝐋 𝐓^-1, Unitful.FreeUnits{(a₀, s^-1), 𝐋 𝐓^-1, nothing}}, Quantity{Float64, 𝐌, Unitful.FreeUnits{(u,), 𝐌, nothing}}}, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}}, p::MockEmpiricalPotential, data::Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}) @ InteratomicPotentials ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:35 [4] energy_and_force(s::FlexibleSystem{3, Atom{3, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}, Quantity{Float64, 𝐋 𝐓^-1, Unitful.FreeUnits{(a₀, s^-1), 𝐋 𝐓^-1, nothing}}, Quantity{Float64, 𝐌, Unitful.FreeUnits{(u,), 𝐌, nothing}}}, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}}, p::MockEmpiricalPotential) @ InteratomicPotentials ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:51 [5] top-level scope @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:2 [6] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:1771 [inlined] [7] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:16 [inlined] [8] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:676 [inlined] Empirical Potential Default Implmentation Unit Tests: Error During Test at /home/pkgeval/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:17 Test threw exception Expression: (energy_and_force(system, p)).e == 0.5 * u"hartree" TaskFailedException nested task error: BoundsError: attempt to access 1-element Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}} at index [2] Stacktrace: [1] throw_boundserror(A::Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, I::Tuple{Int64}) @ Base ./essentials.jl:15 [2] getindex @ ./essentials.jl:917 [inlined] [3] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:39 [inlined] [4] (::InteratomicPotentials.var"#_perform_pairwise##6#_perform_pairwise##7"{InteratomicPotentials.var"#_perform_pairwise##8#_perform_pairwise##9"{InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{MockEmpiricalPotential}, MockEmpiricalPotential, Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, Vector{Symbol}, NeighborList, UnitRange{Int64}}})(tid::Int64; onethread::Bool) @ InteratomicPotentials ./threadingconstructs.jl:276 [5] #_perform_pairwise##6 @ ./threadingconstructs.jl:243 [inlined] [6] (::Base.Threads.var"#threading_run##0#threading_run##1"{InteratomicPotentials.var"#_perform_pairwise##6#_perform_pairwise##7"{InteratomicPotentials.var"#_perform_pairwise##8#_perform_pairwise##9"{InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{MockEmpiricalPotential}, MockEmpiricalPotential, Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, Vector{Symbol}, NeighborList, UnitRange{Int64}}}, Int64})() @ Base.Threads ./threadingconstructs.jl:177 Stacktrace: [1] threading_run(fun::InteratomicPotentials.var"#_perform_pairwise##6#_perform_pairwise##7"{InteratomicPotentials.var"#_perform_pairwise##8#_perform_pairwise##9"{InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{MockEmpiricalPotential}, MockEmpiricalPotential, Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, Vector{Symbol}, NeighborList, UnitRange{Int64}}}, static::Bool) @ Base.Threads ./threadingconstructs.jl:196 [2] macro expansion @ ./threadingconstructs.jl:213 [inlined] [3] _perform_pairwise(f::InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{MockEmpiricalPotential}, s::FlexibleSystem{3, Atom{3, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}, Quantity{Float64, 𝐋 𝐓^-1, Unitful.FreeUnits{(a₀, s^-1), 𝐋 𝐓^-1, nothing}}, Quantity{Float64, 𝐌, Unitful.FreeUnits{(u,), 𝐌, nothing}}}, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}}, p::MockEmpiricalPotential, data::Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}) @ InteratomicPotentials ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:35 [4] energy_and_force(s::FlexibleSystem{3, Atom{3, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}, Quantity{Float64, 𝐋 𝐓^-1, Unitful.FreeUnits{(a₀, s^-1), 𝐋 𝐓^-1, nothing}}, Quantity{Float64, 𝐌, Unitful.FreeUnits{(u,), 𝐌, nothing}}}, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}}, p::MockEmpiricalPotential) @ InteratomicPotentials ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:51 [5] top-level scope @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:2 [6] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:1771 [inlined] [7] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:17 [inlined] [8] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:676 [inlined] Empirical Potential Default Implmentation Unit Tests: Error During Test at /home/pkgeval/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:18 Test threw exception Expression: (energy_and_force(system, p)).f == [#= /home/pkgeval/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:19 =# @SVector([-0.125, -0.125, 0.0]) * u"hartree/bohr", #= /home/pkgeval/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:20 =# @SVector([0.125, 0.0, 0.0]) * u"hartree/bohr", #= /home/pkgeval/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:21 =# @SVector([0.0, 0.125, 0.0]) * u"hartree/bohr", #= /home/pkgeval/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:22 =# @SVector([0.0, 0.0, 0.0]) * u"hartree/bohr"] TaskFailedException nested task error: BoundsError: attempt to access 1-element Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}} at index [2] Stacktrace: [1] throw_boundserror(A::Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, I::Tuple{Int64}) @ Base ./essentials.jl:15 [2] getindex @ ./essentials.jl:917 [inlined] [3] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:39 [inlined] [4] (::InteratomicPotentials.var"#_perform_pairwise##6#_perform_pairwise##7"{InteratomicPotentials.var"#_perform_pairwise##8#_perform_pairwise##9"{InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{MockEmpiricalPotential}, MockEmpiricalPotential, Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, Vector{Symbol}, NeighborList, UnitRange{Int64}}})(tid::Int64; onethread::Bool) @ InteratomicPotentials ./threadingconstructs.jl:276 [5] #_perform_pairwise##6 @ ./threadingconstructs.jl:243 [inlined] [6] (::Base.Threads.var"#threading_run##0#threading_run##1"{InteratomicPotentials.var"#_perform_pairwise##6#_perform_pairwise##7"{InteratomicPotentials.var"#_perform_pairwise##8#_perform_pairwise##9"{InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{MockEmpiricalPotential}, MockEmpiricalPotential, Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, Vector{Symbol}, NeighborList, UnitRange{Int64}}}, Int64})() @ Base.Threads ./threadingconstructs.jl:177 Stacktrace: [1] threading_run(fun::InteratomicPotentials.var"#_perform_pairwise##6#_perform_pairwise##7"{InteratomicPotentials.var"#_perform_pairwise##8#_perform_pairwise##9"{InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{MockEmpiricalPotential}, MockEmpiricalPotential, Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, Vector{Symbol}, NeighborList, UnitRange{Int64}}}, static::Bool) @ Base.Threads ./threadingconstructs.jl:196 [2] macro expansion @ ./threadingconstructs.jl:213 [inlined] [3] _perform_pairwise(f::InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{MockEmpiricalPotential}, s::FlexibleSystem{3, Atom{3, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}, Quantity{Float64, 𝐋 𝐓^-1, Unitful.FreeUnits{(a₀, s^-1), 𝐋 𝐓^-1, nothing}}, Quantity{Float64, 𝐌, Unitful.FreeUnits{(u,), 𝐌, nothing}}}, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}}, p::MockEmpiricalPotential, data::Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}) @ InteratomicPotentials ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:35 [4] energy_and_force(s::FlexibleSystem{3, Atom{3, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}, Quantity{Float64, 𝐋 𝐓^-1, Unitful.FreeUnits{(a₀, s^-1), 𝐋 𝐓^-1, nothing}}, Quantity{Float64, 𝐌, Unitful.FreeUnits{(u,), 𝐌, nothing}}}, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}}, p::MockEmpiricalPotential) @ InteratomicPotentials ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:51 [5] top-level scope @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:2 [6] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:1771 [inlined] [7] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:18 [inlined] [8] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:676 [inlined] Empirical Potential Default Implmentation Unit Tests: Error During Test at /home/pkgeval/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:24 Test threw exception Expression: virial_stress(system, p) isa SVector{6, <:Unitful.Energy} TaskFailedException nested task error: BoundsError: attempt to access 1-element Vector{Tuple{MVector{6, Float64}}} at index [2] Stacktrace: [1] throw_boundserror(A::Vector{Tuple{MVector{6, Float64}}}, I::Tuple{Int64}) @ Base ./essentials.jl:15 [2] getindex @ ./essentials.jl:917 [inlined] [3] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:39 [inlined] [4] (::InteratomicPotentials.var"#_perform_pairwise##6#_perform_pairwise##7"{InteratomicPotentials.var"#_perform_pairwise##8#_perform_pairwise##9"{InteratomicPotentials.var"#virial_stress##0#virial_stress##1"{MockEmpiricalPotential}, MockEmpiricalPotential, Vector{Tuple{MVector{6, Float64}}}, Vector{Symbol}, NeighborList, UnitRange{Int64}}})(tid::Int64; onethread::Bool) @ InteratomicPotentials ./threadingconstructs.jl:276 [5] #_perform_pairwise##6 @ ./threadingconstructs.jl:243 [inlined] [6] (::Base.Threads.var"#threading_run##0#threading_run##1"{InteratomicPotentials.var"#_perform_pairwise##6#_perform_pairwise##7"{InteratomicPotentials.var"#_perform_pairwise##8#_perform_pairwise##9"{InteratomicPotentials.var"#virial_stress##0#virial_stress##1"{MockEmpiricalPotential}, MockEmpiricalPotential, Vector{Tuple{MVector{6, Float64}}}, Vector{Symbol}, NeighborList, UnitRange{Int64}}}, Int64})() @ Base.Threads ./threadingconstructs.jl:177 Stacktrace: [1] threading_run(fun::InteratomicPotentials.var"#_perform_pairwise##6#_perform_pairwise##7"{InteratomicPotentials.var"#_perform_pairwise##8#_perform_pairwise##9"{InteratomicPotentials.var"#virial_stress##0#virial_stress##1"{MockEmpiricalPotential}, MockEmpiricalPotential, Vector{Tuple{MVector{6, Float64}}}, Vector{Symbol}, NeighborList, UnitRange{Int64}}}, static::Bool) @ Base.Threads ./threadingconstructs.jl:196 [2] macro expansion @ ./threadingconstructs.jl:213 [inlined] [3] _perform_pairwise(f::InteratomicPotentials.var"#virial_stress##0#virial_stress##1"{MockEmpiricalPotential}, s::FlexibleSystem{3, Atom{3, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}, Quantity{Float64, 𝐋 𝐓^-1, Unitful.FreeUnits{(a₀, s^-1), 𝐋 𝐓^-1, nothing}}, Quantity{Float64, 𝐌, Unitful.FreeUnits{(u,), 𝐌, nothing}}}, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}}, p::MockEmpiricalPotential, data::Tuple{MVector{6, Float64}}) @ InteratomicPotentials ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:35 [4] virial_stress(s::FlexibleSystem{3, Atom{3, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}, Quantity{Float64, 𝐋 𝐓^-1, Unitful.FreeUnits{(a₀, s^-1), 𝐋 𝐓^-1, nothing}}, Quantity{Float64, 𝐌, Unitful.FreeUnits{(u,), 𝐌, nothing}}}, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}}, p::MockEmpiricalPotential) @ InteratomicPotentials ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:62 [5] top-level scope @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:2 [6] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:1771 [inlined] [7] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:24 [inlined] [8] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:676 [inlined] Empirical Potential Default Implmentation Unit Tests: Error During Test at /home/pkgeval/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:25 Test threw exception Expression: virial_stress(system, p) == #= /home/pkgeval/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:25 =# @SVector([0.0625, 0.0625, 0.0, 0.0, 0.0, 0.0]) * u"hartree" TaskFailedException nested task error: BoundsError: attempt to access 1-element Vector{Tuple{MVector{6, Float64}}} at index [2] Stacktrace: [1] throw_boundserror(A::Vector{Tuple{MVector{6, Float64}}}, I::Tuple{Int64}) @ Base ./essentials.jl:15 [2] getindex @ ./essentials.jl:917 [inlined] [3] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:39 [inlined] [4] (::InteratomicPotentials.var"#_perform_pairwise##6#_perform_pairwise##7"{InteratomicPotentials.var"#_perform_pairwise##8#_perform_pairwise##9"{InteratomicPotentials.var"#virial_stress##0#virial_stress##1"{MockEmpiricalPotential}, MockEmpiricalPotential, Vector{Tuple{MVector{6, Float64}}}, Vector{Symbol}, NeighborList, UnitRange{Int64}}})(tid::Int64; onethread::Bool) @ InteratomicPotentials ./threadingconstructs.jl:276 [5] #_perform_pairwise##6 @ ./threadingconstructs.jl:243 [inlined] [6] (::Base.Threads.var"#threading_run##0#threading_run##1"{InteratomicPotentials.var"#_perform_pairwise##6#_perform_pairwise##7"{InteratomicPotentials.var"#_perform_pairwise##8#_perform_pairwise##9"{InteratomicPotentials.var"#virial_stress##0#virial_stress##1"{MockEmpiricalPotential}, MockEmpiricalPotential, Vector{Tuple{MVector{6, Float64}}}, Vector{Symbol}, NeighborList, UnitRange{Int64}}}, Int64})() @ Base.Threads ./threadingconstructs.jl:177 Stacktrace: [1] threading_run(fun::InteratomicPotentials.var"#_perform_pairwise##6#_perform_pairwise##7"{InteratomicPotentials.var"#_perform_pairwise##8#_perform_pairwise##9"{InteratomicPotentials.var"#virial_stress##0#virial_stress##1"{MockEmpiricalPotential}, MockEmpiricalPotential, Vector{Tuple{MVector{6, Float64}}}, Vector{Symbol}, NeighborList, UnitRange{Int64}}}, static::Bool) @ Base.Threads ./threadingconstructs.jl:196 [2] macro expansion @ ./threadingconstructs.jl:213 [inlined] [3] _perform_pairwise(f::InteratomicPotentials.var"#virial_stress##0#virial_stress##1"{MockEmpiricalPotential}, s::FlexibleSystem{3, Atom{3, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}, Quantity{Float64, 𝐋 𝐓^-1, Unitful.FreeUnits{(a₀, s^-1), 𝐋 𝐓^-1, nothing}}, Quantity{Float64, 𝐌, Unitful.FreeUnits{(u,), 𝐌, nothing}}}, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}}, p::MockEmpiricalPotential, data::Tuple{MVector{6, Float64}}) @ InteratomicPotentials ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:35 [4] virial_stress(s::FlexibleSystem{3, Atom{3, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}, Quantity{Float64, 𝐋 𝐓^-1, Unitful.FreeUnits{(a₀, s^-1), 𝐋 𝐓^-1, nothing}}, Quantity{Float64, 𝐌, Unitful.FreeUnits{(u,), 𝐌, nothing}}}, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}}, p::MockEmpiricalPotential) @ InteratomicPotentials ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:62 [5] top-level scope @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:2 [6] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:1771 [inlined] [7] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/unit/types/empirical_potential.jl:25 [inlined] [8] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:676 [inlined] Mixed Potential Unit Tests: Error During Test at /home/pkgeval/.julia/packages/InteratomicPotentials/NgDLn/test/unit/mixed/linear_combination_potential.jl:1 Got exception outside of a @test TaskFailedException nested task error: BoundsError: attempt to access 1-element Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}} at index [2] Stacktrace: [1] throw_boundserror(A::Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, I::Tuple{Int64}) @ Base ./essentials.jl:15 [2] getindex @ ./essentials.jl:917 [inlined] [3] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:39 [inlined] [4] (::InteratomicPotentials.var"#_perform_pairwise##6#_perform_pairwise##7"{InteratomicPotentials.var"#_perform_pairwise##8#_perform_pairwise##9"{InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{MockEmpiricalPotential}, MockEmpiricalPotential, Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, Vector{Symbol}, NeighborList, UnitRange{Int64}}})(tid::Int64; onethread::Bool) @ InteratomicPotentials ./threadingconstructs.jl:276 [5] #_perform_pairwise##6 @ ./threadingconstructs.jl:243 [inlined] [6] (::Base.Threads.var"#threading_run##0#threading_run##1"{InteratomicPotentials.var"#_perform_pairwise##6#_perform_pairwise##7"{InteratomicPotentials.var"#_perform_pairwise##8#_perform_pairwise##9"{InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{MockEmpiricalPotential}, MockEmpiricalPotential, Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, Vector{Symbol}, NeighborList, UnitRange{Int64}}}, Int64})() @ Base.Threads ./threadingconstructs.jl:177 Stacktrace: [1] threading_run(fun::InteratomicPotentials.var"#_perform_pairwise##6#_perform_pairwise##7"{InteratomicPotentials.var"#_perform_pairwise##8#_perform_pairwise##9"{InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{MockEmpiricalPotential}, MockEmpiricalPotential, Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, Vector{Symbol}, NeighborList, UnitRange{Int64}}}, static::Bool) @ Base.Threads ./threadingconstructs.jl:196 [2] macro expansion @ ./threadingconstructs.jl:213 [inlined] [3] _perform_pairwise(f::InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{MockEmpiricalPotential}, s::FlexibleSystem{3, Atom{3, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}, Quantity{Float64, 𝐋 𝐓^-1, Unitful.FreeUnits{(a₀, s^-1), 𝐋 𝐓^-1, nothing}}, Quantity{Float64, 𝐌, Unitful.FreeUnits{(u,), 𝐌, nothing}}}, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}}, p::MockEmpiricalPotential, data::Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}) @ InteratomicPotentials ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:35 [4] energy_and_force(s::FlexibleSystem{3, Atom{3, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}, Quantity{Float64, 𝐋 𝐓^-1, Unitful.FreeUnits{(a₀, s^-1), 𝐋 𝐓^-1, nothing}}, Quantity{Float64, 𝐌, Unitful.FreeUnits{(u,), 𝐌, nothing}}}, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}}, p::MockEmpiricalPotential) @ InteratomicPotentials ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:51 [5] potential_energy(s::FlexibleSystem{3, Atom{3, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}, Quantity{Float64, 𝐋 𝐓^-1, Unitful.FreeUnits{(a₀, s^-1), 𝐋 𝐓^-1, nothing}}, Quantity{Float64, 𝐌, Unitful.FreeUnits{(u,), 𝐌, nothing}}}, Quantity{Float64, 𝐋, Unitful.FreeUnits{(a₀,), 𝐋, nothing}}}, p::MockEmpiricalPotential) @ InteratomicPotentials ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/abstract_potential.jl:8 [6] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/unit/mixed/linear_combination_potential.jl:34 [inlined] [7] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:1771 [inlined] [8] top-level scope @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/unit/mixed/linear_combination_potential.jl:2 [9] include(mapexpr::Function, mod::Module, _path::String) @ Base ./Base.jl:304 [10] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/runtests.jl:34 [inlined] [11] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:1771 [inlined] [12] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/runtests.jl:34 [inlined] [13] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:1771 [inlined] [14] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/runtests.jl:17 [inlined] [15] macro expansion @ ./timing.jl:621 [inlined] [16] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/runtests.jl:16 [inlined] [17] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:1771 [inlined] [18] top-level scope @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/runtests.jl:16 [19] include(mapexpr::Function, mod::Module, _path::String) @ Base ./Base.jl:304 [20] top-level scope @ none:6 [21] eval(m::Module, e::Any) @ Core ./boot.jl:489 [22] exec_options(opts::Base.JLOptions) @ Base ./client.jl:294 [23] _start() @ Base ./client.jl:560 52.146647 seconds (24.57 M allocations: 1.306 GiB, 0.99% gc time, 90.28% compilation time: <1% of which was recompilation) Lennard Jones 150 Cluster Test: Error During Test at /home/pkgeval/.julia/packages/InteratomicPotentials/NgDLn/test/integration/lj_clusters/lj_150.jl:1 Got exception outside of a @test TaskFailedException nested task error: BoundsError: attempt to access 1-element Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}} at index [2] Stacktrace: [1] throw_boundserror(A::Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, I::Tuple{Int64}) @ Base ./essentials.jl:15 [2] getindex @ ./essentials.jl:917 [inlined] [3] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:30 [inlined] [4] (::InteratomicPotentials.var"#_perform_pairwise##2#_perform_pairwise##3"{InteratomicPotentials.var"#_perform_pairwise##4#_perform_pairwise##5"{InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{LennardJones{Float64}}, Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, NeighborList, UnitRange{Int64}}})(tid::Int64; onethread::Bool) @ InteratomicPotentials ./threadingconstructs.jl:276 [5] #_perform_pairwise##2 @ ./threadingconstructs.jl:243 [inlined] [6] (::Base.Threads.var"#threading_run##0#threading_run##1"{InteratomicPotentials.var"#_perform_pairwise##2#_perform_pairwise##3"{InteratomicPotentials.var"#_perform_pairwise##4#_perform_pairwise##5"{InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{LennardJones{Float64}}, Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, NeighborList, UnitRange{Int64}}}, Int64})() @ Base.Threads ./threadingconstructs.jl:177 Stacktrace: [1] threading_run(fun::InteratomicPotentials.var"#_perform_pairwise##2#_perform_pairwise##3"{InteratomicPotentials.var"#_perform_pairwise##4#_perform_pairwise##5"{InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{LennardJones{Float64}}, Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, NeighborList, UnitRange{Int64}}}, static::Bool) @ Base.Threads ./threadingconstructs.jl:196 [2] macro expansion @ ./threadingconstructs.jl:213 [inlined] [3] _perform_pairwise(f::InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{LennardJones{Float64}}, s::FlexibleSystem{3, Atom{3, Quantity{Float64, 𝐋, Unitful.FreeUnits{(Å,), 𝐋, nothing}}, Quantity{Float64, 𝐋 𝐓^-1, Unitful.FreeUnits{(a₀, s^-1), 𝐋 𝐓^-1, nothing}}, Quantity{Float64, 𝐌, Unitful.FreeUnits{(u,), 𝐌, nothing}}}, Quantity{Float64, 𝐋, Unitful.FreeUnits{(Å,), 𝐋, nothing}}}, p::LennardJones{Float64}, data::Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}) @ InteratomicPotentials ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:28 [4] energy_and_force(s::FlexibleSystem{3, Atom{3, Quantity{Float64, 𝐋, Unitful.FreeUnits{(Å,), 𝐋, nothing}}, Quantity{Float64, 𝐋 𝐓^-1, Unitful.FreeUnits{(a₀, s^-1), 𝐋 𝐓^-1, nothing}}, Quantity{Float64, 𝐌, Unitful.FreeUnits{(u,), 𝐌, nothing}}}, Quantity{Float64, 𝐋, Unitful.FreeUnits{(Å,), 𝐋, nothing}}}, p::LennardJones{Float64}) @ InteratomicPotentials ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:51 [5] top-level scope @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/integration/lj_clusters/lj_150.jl:2 [6] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:1771 [inlined] [7] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/integration/lj_clusters/lj_150.jl:16 [inlined] [8] include(mapexpr::Function, mod::Module, _path::String) @ Base ./Base.jl:304 [9] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/runtests.jl:42 [inlined] [10] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:1771 [inlined] [11] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/runtests.jl:42 [inlined] [12] macro expansion @ ./timing.jl:621 [inlined] [13] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/runtests.jl:41 [inlined] [14] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:1771 [inlined] [15] top-level scope @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/runtests.jl:16 [16] include(mapexpr::Function, mod::Module, _path::String) @ Base ./Base.jl:304 [17] top-level scope @ none:6 [18] eval(m::Module, e::Any) @ Core ./boot.jl:489 [19] exec_options(opts::Base.JLOptions) @ Base ./client.jl:294 [20] _start() @ Base ./client.jl:560 Lennard Jones 1000 Cluster Test: Error During Test at /home/pkgeval/.julia/packages/InteratomicPotentials/NgDLn/test/integration/lj_clusters/lj_1000.jl:1 Got exception outside of a @test TaskFailedException nested task error: BoundsError: attempt to access 1-element Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}} at index [2] Stacktrace: [1] throw_boundserror(A::Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, I::Tuple{Int64}) @ Base ./essentials.jl:15 [2] getindex @ ./essentials.jl:917 [inlined] [3] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:30 [inlined] [4] (::InteratomicPotentials.var"#_perform_pairwise##2#_perform_pairwise##3"{InteratomicPotentials.var"#_perform_pairwise##4#_perform_pairwise##5"{InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{LennardJones{Float64}}, Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, NeighborList, UnitRange{Int64}}})(tid::Int64; onethread::Bool) @ InteratomicPotentials ./threadingconstructs.jl:276 [5] #_perform_pairwise##2 @ ./threadingconstructs.jl:243 [inlined] [6] (::Base.Threads.var"#threading_run##0#threading_run##1"{InteratomicPotentials.var"#_perform_pairwise##2#_perform_pairwise##3"{InteratomicPotentials.var"#_perform_pairwise##4#_perform_pairwise##5"{InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{LennardJones{Float64}}, Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, NeighborList, UnitRange{Int64}}}, Int64})() @ Base.Threads ./threadingconstructs.jl:177 Stacktrace: [1] threading_run(fun::InteratomicPotentials.var"#_perform_pairwise##2#_perform_pairwise##3"{InteratomicPotentials.var"#_perform_pairwise##4#_perform_pairwise##5"{InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{LennardJones{Float64}}, Vector{Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}}, NeighborList, UnitRange{Int64}}}, static::Bool) @ Base.Threads ./threadingconstructs.jl:196 [2] macro expansion @ ./threadingconstructs.jl:213 [inlined] [3] _perform_pairwise(f::InteratomicPotentials.var"#energy_and_force##0#energy_and_force##1"{LennardJones{Float64}}, s::FlexibleSystem{3, Atom{3, Quantity{Float64, 𝐋, Unitful.FreeUnits{(Å,), 𝐋, nothing}}, Quantity{Float64, 𝐋 𝐓^-1, Unitful.FreeUnits{(a₀, s^-1), 𝐋 𝐓^-1, nothing}}, Quantity{Float64, 𝐌, Unitful.FreeUnits{(u,), 𝐌, nothing}}}, Quantity{Float64, 𝐋, Unitful.FreeUnits{(Å,), 𝐋, nothing}}}, p::LennardJones{Float64}, data::Tuple{MVector{1, Float64}, Vector{MVector{3, Float64}}}) @ InteratomicPotentials ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:28 [4] energy_and_force(s::FlexibleSystem{3, Atom{3, Quantity{Float64, 𝐋, Unitful.FreeUnits{(Å,), 𝐋, nothing}}, Quantity{Float64, 𝐋 𝐓^-1, Unitful.FreeUnits{(a₀, s^-1), 𝐋 𝐓^-1, nothing}}, Quantity{Float64, 𝐌, Unitful.FreeUnits{(u,), 𝐌, nothing}}}, Quantity{Float64, 𝐋, Unitful.FreeUnits{(Å,), 𝐋, nothing}}}, p::LennardJones{Float64}) @ InteratomicPotentials ~/.julia/packages/InteratomicPotentials/NgDLn/src/types/empirical_potential.jl:51 [5] top-level scope @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/integration/lj_clusters/lj_1000.jl:2 [6] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:1771 [inlined] [7] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/integration/lj_clusters/lj_1000.jl:16 [inlined] [8] include(mapexpr::Function, mod::Module, _path::String) @ Base ./Base.jl:304 [9] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/runtests.jl:43 [inlined] [10] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:1771 [inlined] [11] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/runtests.jl:42 [inlined] [12] macro expansion @ ./timing.jl:621 [inlined] [13] macro expansion @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/runtests.jl:41 [inlined] [14] macro expansion @ /opt/julia/share/julia/stdlib/v1.12/Test/src/Test.jl:1771 [inlined] [15] top-level scope @ ~/.julia/packages/InteratomicPotentials/NgDLn/test/runtests.jl:16 [16] include(mapexpr::Function, mod::Module, _path::String) @ Base ./Base.jl:304 [17] top-level scope @ none:6 [18] eval(m::Module, e::Any) @ Core ./boot.jl:489 [19] exec_options(opts::Base.JLOptions) @ Base ./client.jl:294 [20] _start() @ Base ./client.jl:560 6.460486 seconds (3.36 M allocations: 231.645 MiB, 1.03% gc time, 74.83% compilation time) Test Summary: | Pass Error Total Time Potentials.jl | 97 8 105 58.8s Unit Tests | 97 6 103 52.1s Physical Constants | 2 2 12.5s Unit Convention | 4 4 0.2s Neighbor List Unit Tests | 3 3 9.4s Default Implementations | 23 5 28 17.2s Abstract Potential Default Implmentation Unit Tests | 5 5 2.5s Non-Trainable Potential Default Implmentation Unit Tests | 8 8 0.0s Trainable Potential Default Implmentation Unit Tests | 8 8 0.8s Empirical Potential Default Implmentation Unit Tests | 2 5 7 13.8s Empirical Potentials | 65 65 8.8s Mixed Potentials | 1 1 3.4s Mixed Potential Unit Tests | 1 1 3.0s Integration Tests | 2 2 6.5s Lennard Jones 150 Cluster Test | 1 1 4.8s Lennard Jones 1000 Cluster Test | 1 1 1.2s RNG of the outermost testset: Random.Xoshiro(0x8fa42c77f8e79321, 0xdb8971792a26e13f, 0x285aa889fbad59a8, 0x5ad3b7d1ec05bdf8, 0x67cfd252d5e728ee) ERROR: LoadError: Some tests did not pass: 97 passed, 0 failed, 8 errored, 0 broken. in expression starting at /home/pkgeval/.julia/packages/InteratomicPotentials/NgDLn/test/runtests.jl:12 Testing failed after 81.66s ERROR: LoadError: Package InteratomicPotentials 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 245.03s: package tests unexpectedly errored