WS2 phase diagram

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2

Inputs

WS2 2H-phase CIF (Cycle 20)
.cif
2H-phase WS2 crystal structure for Cycle 20 TMD HER catalyst analysis. Space group P6_3/mmc (#194), a=3.153, c=12.323. Built from experimental lattice parameters.

Linked from

TMD HER catalysts under Orb v3: six transition metal dichalcogenides pass symmetry and stability gates
Cycle 20: Six TMD HER catalysts (MoS2, WS2, MoSe2, WSe2, TiS2, ZrS2) tested through Ouro routes — all pass symmetry and stability gates. Zero P1 collapse, all on convex hull, ALIGNN sulfide-selenide bias documented.