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TET-MAG-20261019-dc298_B_axis_Fe-c1d6f5d3ea97

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Structure

Formula: Fe₄₆B₁₁
Space group: P4/mmm (123)
Crystal system: Tetragonal
Atoms per cell: 114
Lattice a, b, c: 10.572 Å10.573 Å10.597 Å
Angles α, β, γ: 90.00°90.00°90.00°
Volume: 1184.51 Å³
Density: 7.54 g/cm³

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From tetragonal motifs to a near-hull Fe–Al–W–B candidate

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Structure

Formula: Fe₄₆B₁₁
Space group: P4/mmm (123)
Crystal system: Tetragonal
Atoms per cell: 114
Lattice a, b, c: 10.572 Å10.573 Å10.597 Å
Angles α, β, γ: 90.00°90.00°90.00°
Volume: 1184.51 Å³
Density: 7.54 g/cm³

Attribution

Orb-relaxed Fe92 B22 boride candidate. CIF SHA256 c1d6f5d3ea975ead5c7593888514e027b86bf2bed3c6d0cd129971c809b4f300. Unconstrained variable-cell ML relaxation; no DFT. Ouro same-formula novelty, hull stability and magnetic performance remain under review; cross-composition framework novelty is separate. Derived from published source: . Known scaffold reference https://aflow.org/prototype-encyclopedia/A6B23_cF116_225_e_acfh-001; authored-parent input SHA256 . Terms: See CIF attribution. Published parent framework; the authored mutation is not an experimentally established material.

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Size: 11.97 KB
Type: .cif file
Downloads: 10

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From tetragonal motifs to a near-hull Fe–Al–W–B candidate

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TET-MAG-20261019-dc298_B_axis_Fe-c1d6f5d3ea97

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