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Matt Moderwell

@mmoderwell

Building Ouro, using AI to search for room-temp superconductors and rare-earth free permanent magnets.

6505 XPLevel 66
16 followers24 following
2.22K files5 datasets13 services

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  • Files

    1623 total

    MnFe4(CoB2)2 phase diagram 6

    .html

    Phase diagram of MnFe4(CoB2)2; eabovehull: 0.238665 eV/atom; predicted_stable: False

    7mo

    MnFe4(CoB2)2_SG1_n11atoms.cif 4 - phonon dispersion

    Image

    Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -2.09 THz

    7mo

    Mn2Cr(FeB)4_SG1_n11atoms.cif - phonon dispersion

    Image

    Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.11 THz

    7mo

    Mn2Cr(FeB)4 phase diagram

    .html

    Phase diagram of Mn2Cr(FeB)4; eabovehull: 0.237263 eV/atom; predicted_stable: False

    7mo

    Mn2Fe5B6 phase diagram

    .html

    Phase diagram of Mn2Fe5B6; eabovehull: 0.322507 eV/atom; predicted_stable: False

    7mo

    Fe5Mn2B6_SG156_generated_n13atoms.cif - phonon dispersion

    Image

    Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.00 THz

    7mo

    Fe5Mn2B4_SG47_generated_n11atoms.cif - phonon dispersion

    Image

    Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -8.77 THz

    7mo

    Mn2Fe5B4 phase diagram

    .html

    Phase diagram of Mn2Fe5B4; eabovehull: 0.361407 eV/atom; predicted_stable: False

    7mo

    Mn2Fe4NiB4 phase diagram

    .html

    Phase diagram of Mn2Fe4NiB4; eabovehull: 0.208114 eV/atom; predicted_stable: False

    7mo

    Mn2Fe4NiB4_SG1_n11atoms.cif - phonon dispersion

    Image

    Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.10 THz

    7mo

    Mn2Fe4CoB4 phase diagram 3

    .html

    Phase diagram of Mn2Fe4CoB4; eabovehull: 0.567370 eV/atom; predicted_stable: False

    7mo

    Fe4Co1Mn2B4_SG123_generated_n11atoms.cif - phonon dispersion

    Image

    Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -8.79 THz

    7mo

    Mn2Fe4CoB4 phase diagram 2

    .html

    Phase diagram of Mn2Fe4CoB4; eabovehull: 0.205747 eV/atom; predicted_stable: False

    7mo

    Mn2Fe4CoB4_SG1_n11atoms.cif - phonon dispersion

    Image

    Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); imaginary modes detected; min freq = -0.37 THz

    7mo

    Fe4Mn3B4 (P1) 4 - phonon dispersion

    Image

    Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.04 THz

    7mo

    Mn3(FeB)4 phase diagram 12

    .html

    Phase diagram of Mn3(FeB)4; eabovehull: 0.223567 eV/atom; predicted_stable: False

    7mo

    Fe4Mn3B4 (P1) 4

    .cif

    Fe4Mn3B4 (requested SG: P3m1 #156, calculated SG: P1 #1, optimized: 197 steps, cell relaxed (isotropic))

    7mo

    Fe7Co2Ni1Cr1B4_SG1_generated_n15atoms.cif - phonon dispersion

    Image

    Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å); no imaginary modes; min freq = -0.08 THz

    7mo

    CrFe7Co2NiB4 phase diagram 1

    .html

    Phase diagram of CrFe7Co2NiB4; eabovehull: 0.179452 eV/atom; predicted_stable: False

    7mo

    Mn2Fe3CoNiB4 phase diagram

    .html

    Phase diagram of Mn2Fe3CoNiB4; eabovehull: 0.242872 eV/atom; predicted_stable: False

    7mo
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