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Remove EmpricialPotentials from docs
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docs/Project.toml

+3-5
Original file line numberDiff line numberDiff line change
@@ -6,15 +6,13 @@ AtomsCalculators = "a3e0e189-c65a-42c1-833c-339540406eb1"
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AtomsIO = "1692102d-eeb4-4df9-807b-c9517f998d44"
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DFTK = "acf6eb54-70d9-11e9-0013-234b7a5f5337"
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Documenter = "e30172f5-a6a5-5a46-863b-614d45cd2de4"
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EmpiricalPotentials = "38527215-9240-4c91-a638-d4250620c9e2"
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GeometryOptimization = "673bf261-a53d-43b9-876f-d3c1fc8329c2"
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LinearAlgebra = "37e2e46d-f89d-539d-b4ee-838fcccc9c8e"
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OptimizationNLopt = "4e6fcdb7-1186-4e1f-a706-475e75c168bb"
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Unitful = "1986cc42-f94f-5a68-af5c-568840ba703d"
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UnitfulAtomic = "a7773ee8-282e-5fa2-be4e-bd808c38a91a"
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[compat]
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ASEconvert = "0.1"
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DFTK = "0.6"
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Documenter = "~1.5"
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EmpiricalPotentials = "0.1"
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ASEconvert = "0.1.8"
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DFTK = "0.7"
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Documenter = "~1.8"

docs/src/examples/tial_lj.md

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@@ -3,36 +3,38 @@
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TODO Write some text motivating this example
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Setup system:
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```@example tial
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using AtomsBase
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```julia
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## TODO: Should run as @example once EmpiricalPotentials is compatible with AB 0.5
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using AtomsIO
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using EmpiricalPotentials
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using GeometryOptimization
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GO = GeometryOptimization
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system = load_system(joinpath(pkgdir(EmpiricalPotentials), "data/TiAl-1024.xyz"))
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nothing
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```
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Setup calculator:
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```@example tial
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```julia
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## TODO: Should run as @example once EmpiricalPotentials is compatible with AB 0.5
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using Unitful
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using UnitfulAtomic
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calc = LennardJones(-1.0u"meV", 3.1u"Å", 13, 13, 6.0u"Å")
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nothing
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```
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Minimise energy:
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```julia
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## TODO: Should run as @example once EmpiricalPotentials is compatible
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## TODO: Should run as @example once EmpiricalPotentials is compatible with AB 0.5
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using GeometryOptimization
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GO = GeometryOptimization
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results = minimize_energy!(system, calc, GO.OptimCG(); maxiters=10, verbosity=1)
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results.energy
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```
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Final structure:
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```julia
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## TODO: Should run as @example once EmpiricalPotentials is compatible
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## TODO: Should run as @example once EmpiricalPotentials is compatible with AB 0.5
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results.system
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```

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