Full formulaSpace groupHMHALLLattice systemBand gapStructure fileSource
Au4O4Pr4Te414P21/c-P 2ybcMonoclinic0.00000 eVCIF | POSCAR | LAMMPSOQMD
Li4O4Pr4Te414P21/c-P 2ybcMonoclinic0.00000 eVCIF | POSCAR | LAMMPSOQMD
BeEuPa216F-43mF -4 2 3Cubic0.00000 eVCIF | POSCAR | LAMMPSOQMD
Cu4Nd4O4Te414P21/c-P 2ybcMonoclinic0.00000 eVCIF | POSCAR | LAMMPSOQMD
Li4O4Te4Yb414P21/c-P 2ybcMonoclinic0.00000 eVCIF | POSCAR | LAMMPSOQMD
Cs4O4Se4Tm414P21/c-P 2ybcMonoclinic0.00000 eVCIF | POSCAR | LAMMPSOQMD
Cu4O4Se4Yb414P21/c-P 2ybcMonoclinic0.00000 eVCIF | POSCAR | LAMMPSOQMD
Ag4O4Se4Yb414P21/c-P 2ybcMonoclinic0.00000 eVCIF | POSCAR | LAMMPSOQMD
AcLaPa216F-43mF -4 2 3Cubic0.00000 eVCIF | POSCAR | LAMMPSOQMD
Au4O4Se4Yb414P21/c-P 2ybcMonoclinic0.00000 eVCIF | POSCAR | LAMMPSOQMD
Hg4O4Se4Yb414P21/c-P 2ybcMonoclinic0.00000 eVCIF | POSCAR | LAMMPSOQMD
Li4O4Se4Yb414P21/c-P 2ybcMonoclinic0.00000 eVCIF | POSCAR | LAMMPSOQMD
Na4O4Se4Yb414P21/c-P 2ybcMonoclinic0.00000 eVCIF | POSCAR | LAMMPSOQMD