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chore: add hse06 to tree
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azech-hqs committed Sep 15, 2023
1 parent a3e5d79 commit e141a85
Showing 1 changed file with 2 additions and 2 deletions.
4 changes: 2 additions & 2 deletions src/tree.js
Original file line number Diff line number Diff line change
Expand Up @@ -40,8 +40,8 @@ const DFTModelTree = {
functionals: ["pz", "pw", "vwn", "other"],
},
hybrid: {
methods: { [METHODS.localorbital]: ["pople"] },
functionals: ["b3lyp"],
methods,
functionals: ["b3lyp", "hse06"],
},
other: {
methods,
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