Ba2Cu3FO5Sr (Pmmm) - relaxed
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -62.7596 eV; energy change = -0.9029 eV; symmetry: Pmmm → Pmmm
Ba2Cu3FO5Sr (Pmmm)
.cif fileBa2Cu3FO5Sr (space group: Pmmm #47, crystal system: orthorhombic, point group: mmm)
3moBa2Cu3FO5Sr (Pmmm) - relaxed - phonon dispersion
Image filePhonon band structure (supercell [2, 2, 2], Δ=0.01 Å)
3mo
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