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8mo
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Fe14Bi2N2 (P6_3/mmc) - relaxed

    Get basic structural information from a CIF file

    file.cif→JSON
    9mo

    Calculate phonon dispersion and return band structure plot

    file.cif→file.png
    9mo

    Calculate the estimated raw material cost per kg

    file.cif→JSON
    8mo

    Relax a crystal structure with animation

    file.cif→file.mp4
    8mo

    Relax a crystal structure and create a post

    file.cif→post
    7mo

    Get a detailed description of a crystal structure

    file.cif→JSON
    7mo

    Relax a crystal structure

    file.cif→file.cif
    9mo

    Calculate magnetic anisotropy energy

    file.cif→JSON
    3mo

    Synthesis report from CIF file

    file.cif→file.html
    1mo

    Create interstitially doped structure

    file.cif→file.cif
    8mo

    Predict the Curie temperature of a material

    file.cif→JSON
    11mo

    Calculate magnetic saturation and related properties

    file.cif→JSON
    9mo

    Calculate energy above hull

    file.cif→file.html
    9mo

    Create a supercell from a material

    file.cif→file.cif
    11mo
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1.67 KB
.cif file

Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -145.4401 eV; energy change = -24.6086 eV; symmetry: P6_3/mmc → P1

    1 input asset
    • Fe14Bi2N2 (P6_3/mmc)

      .cif

      Fe14Bi2N2 (space group: P6_3/mmc #194, crystal system: hexagonal, point group: 6/mmm)

      8mo
Relax a crystal structure
ARR license