Orb-relaxed Ti12 Fe46 B16 boride candidate. CIF SHA256 26cb75b2b60b7efebb1c4a3107d9aee9a77dcba73e65cbf7765c4897fd8f0a99. Unconstrained variable-cell ML relaxation; no DFT. AFLOW novelty, hull stability and magnetic performance remain under review. Derived from published source: . Coordinate source https://doi.org/10.1021/ic7020963; source SHA256 7766dd815fd67e540949eba9f04c0415dc9c6ca0a69c3743717e99538c0330cb. Terms: See CIF attribution. Published parent framework; the authored mutation is not an experimentally established material.
provisional K of 1.34