knc6/supercon_tc_jarvis_dft · Datasets at Hugging Face

instruction stringclasses 1 value	input stringlengths 149 157	output stringlengths 44 404	id stringlengths 1 3
Below is a description of a superconductor material.	The chemical formula is BeSiRh2 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.06 4.06 4.06 60 60 60 Be 0.250 0.250 0.250 Si 0.750 0.750 0.750 Rh 0.000 0.000 0.000 Rh 0.500 0.500 0.500	700
Below is a description of a superconductor material.	The chemical formula is LiFeP . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.69 3.69 5.83 90 90 90 Li 0.500 0.000 0.654 Li 0.000 0.500 0.346 Fe 0.500 0.500 0.000 Fe 0.000 0.000 0.000 P 0.000 0.500 0.789 P 0.500 0.000 0.211	701
Below is a description of a superconductor material.	The chemical formula is ScBRh3 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.12 4.12 4.12 90 90 90 Sc 0.000 0.000 0.000 B 0.500 0.500 0.500 Rh 0.000 0.500 0.500 Rh 0.500 0.000 0.500 Rh 0.500 0.500 0.000	702
Below is a description of a superconductor material.	The chemical formula is Be4FeGe . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.24 4.24 4.24 59 59 60 Be 0.624 0.624 0.129 Be 0.624 0.129 0.624 Be 0.129 0.624 0.624 Be 0.624 0.624 0.624 Fe 0.250 0.250 0.250 Ge 0.000 0.000 0.000	703
Below is a description of a superconductor material.	The chemical formula is B2Mo . The Tc_supercon is 13.7. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.02 3.02 3.38 90 90 120 B 0.333 0.667 0.500 B 0.667 0.333 0.500 Mo 0.000 0.000 0.000	704
Below is a description of a superconductor material.	The chemical formula is ScGaCu2 . The Tc_supercon is 2.44. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.37 4.37 4.37 60 60 60 Sc 0.500 0.500 0.500 Ga 0.000 0.000 0.000 Cu 0.750 0.750 0.750 Cu 0.250 0.250 0.250	705
Below is a description of a superconductor material.	The chemical formula is NiMoP2 . The Tc_supercon is 0.22. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.36 3.36 11.25 90 90 120 Ni 0.000 0.000 0.000 Ni 0.000 0.000 0.500 Mo 0.000 0.000 0.250 Mo 0.000 0.000 0.750 P 0.333 0.667 0.613 P 0.667 0.333 0.113 P 0.333 0.667 0.887 P 0.667 0.333 0.387	706
Below is a description of a superconductor material.	The chemical formula is Co3W . The Tc_supercon is 0.09. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.59 3.59 3.59 90 90 90 Co 0.500 0.500 0.000 Co 0.500 0.000 0.500 Co 0.000 0.500 0.500 W 0.000 0.000 0.000	707
Below is a description of a superconductor material.	The chemical formula is TiB2Mo . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.52 4.52 3.08 90 90 138 Ti 0.852 0.148 0.000 B 0.442 0.558 0.500 B 0.559 0.441 0.000 Mo 0.147 0.853 0.500	708
Below is a description of a superconductor material.	The chemical formula is Sc2IrRu . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.54 4.54 4.54 60 60 60 Sc 0.000 0.000 0.000 Sc 0.500 0.500 0.500 Ir 0.250 0.250 0.250 Ru 0.750 0.750 0.750	709
Below is a description of a superconductor material.	The chemical formula is V2InC . The Tc_supercon is 0.63. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.04 3.04 13.52 90 90 119 V 0.333 0.667 0.078 V 0.333 0.667 0.422 V 0.667 0.333 0.578 V 0.667 0.333 0.922 In 0.333 0.667 0.750 In 0.667 0.333 0.250 C 0.000 0.000 0.000 C 0.000 0.000 0.500	710
Below is a description of a superconductor material.	The chemical formula is Ti2AlCr . The Tc_supercon is 6.44. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.12 3.12 6.18 90 90 90 Ti 0.500 0.500 0.277 Ti 0.500 0.500 0.723 Al 0.000 0.000 0.000 Cr 0.000 0.000 0.500	711
Below is a description of a superconductor material.	The chemical formula is AsHO . The Tc_supercon is 19.92. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.60 3.60 4.99 90 90 90 As 0.500 0.000 0.267 As 0.000 0.500 0.733 H 0.000 0.000 0.000 H 0.500 0.500 0.000 O 0.000 0.000 0.500 O 0.500 0.500 0.500	712
Below is a description of a superconductor material.	The chemical formula is Sc2CoRu . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.46 4.46 4.46 60 60 60 Sc 0.000 0.000 0.000 Sc 0.500 0.500 0.500 Co 0.250 0.250 0.250 Ru 0.750 0.750 0.750	713
Below is a description of a superconductor material.	The chemical formula is GaGeRu2 . The Tc_supercon is 3.64. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.29 4.29 4.29 60 60 60 Ga 0.250 0.250 0.250 Ge 0.750 0.750 0.750 Ru 0.000 0.000 0.000 Ru 0.500 0.500 0.500	714
Below is a description of a superconductor material.	The chemical formula is TiBe2Ge . The Tc_supercon is 0.25. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.65 3.65 3.60 90 90 90 Ti 0.000 0.000 0.500 Be 0.500 0.000 0.000 Be 0.000 0.500 0.000 Ge 0.500 0.500 0.500	715
Below is a description of a superconductor material.	The chemical formula is CoN . The Tc_supercon is 14.5. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.01 3.01 3.01 60 60 60 Co 0.000 0.000 0.000 N 0.250 0.250 0.250	716
Below is a description of a superconductor material.	The chemical formula is Be2RuRh . The Tc_supercon is 3.5. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	9.54 6.75 6.75 34 19 19 Be 0.748 0.001 0.001 Be 0.252 -0.001 -0.001 Ru -0.000 0.000 0.000 Rh 0.500 -0.000 -0.000	717
Below is a description of a superconductor material.	The chemical formula is KP . The Tc_supercon is 0.96. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.28 3.02 4.98 90 90 45 K 0.057 0.906 0.917 P 0.557 0.906 0.417	718
Below is a description of a superconductor material.	The chemical formula is NbRh3 . The Tc_supercon is 0.1. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.90 3.90 3.90 90 90 90 Nb 0.000 0.000 0.000 Rh 0.000 0.500 0.500 Rh 0.500 0.500 0.000 Rh 0.500 0.000 0.500	719
Below is a description of a superconductor material.	The chemical formula is Mn3RhN . The Tc_supercon is 10.13. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.76 3.76 3.76 90 90 90 Mn 0.500 0.500 0.000 Mn 0.500 0.000 0.500 Mn 0.000 0.500 0.500 Rh 0.000 0.000 0.000 N 0.500 0.500 0.500	720
Below is a description of a superconductor material.	The chemical formula is MgBe2Pd . The Tc_supercon is 4.42. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.09 4.09 4.09 119 119 90 Mg 0.250 0.750 0.500 Be 0.000 0.000 0.000 Be 0.500 0.500 0.000 Pd 0.750 0.250 0.500	721
Below is a description of a superconductor material.	The chemical formula is YSiO3 . The Tc_supercon is 7.36. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.70 3.70 3.70 90 90 90 Y 0.000 0.000 0.000 Si 0.500 0.500 0.500 O 0.500 0.500 0.000 O 0.500 0.000 0.500 O 0.000 0.500 0.500	722
Below is a description of a superconductor material.	The chemical formula is TiSi . The Tc_supercon is 5.64. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.64 4.74 4.74 53 67 67 Ti 0.500 0.449 0.551 Ti -0.000 0.949 0.051 Si 0.750 0.699 0.801 Si 0.250 0.199 0.301	723
Below is a description of a superconductor material.	The chemical formula is TaTiOs2 . The Tc_supercon is 6.62. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.45 4.45 4.45 60 60 60 Ta 0.250 0.250 0.250 Ti 0.750 0.750 0.750 Os 0.000 0.000 0.000 Os 0.500 0.500 0.500	724
Below is a description of a superconductor material.	The chemical formula is ScC . The Tc_supercon is 3.93. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.31 3.31 3.31 60 60 60 Sc 0.000 0.000 0.000 C 0.500 0.500 0.500	725
Below is a description of a superconductor material.	The chemical formula is VRu . The Tc_supercon is 20.26. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.01 3.01 3.01 90 90 90 V 0.500 0.500 0.500 Ru 0.000 0.000 0.000	726
Below is a description of a superconductor material.	The chemical formula is NbN . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.98 2.98 2.91 90 90 119 Nb 0.333 0.667 0.500 N 0.000 0.000 0.000	727
Below is a description of a superconductor material.	The chemical formula is TaCo3 . The Tc_supercon is 0.01. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.14 5.16 5.16 120 90 90 Ta 0.750 0.667 0.333 Ta 0.250 0.333 0.667 Co 0.750 0.158 0.316 Co 0.750 0.158 0.842 Co 0.750 0.684 0.842 Co 0.250 0.842 0.684 Co 0.250 0.842 0.158 Co 0.250 0.316 0.158	728
Below is a description of a superconductor material.	The chemical formula is AlSbO . The Tc_supercon is 7.49. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.13 3.13 6.83 90 90 90 Al 0.000 0.000 0.432 Sb 0.000 0.000 -0.029 O 0.000 0.000 0.681	729
Below is a description of a superconductor material.	The chemical formula is CoO2 . The Tc_supercon is 16.15. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.75 4.75 4.75 34 34 34 Co 0.000 0.000 0.000 O 0.598 0.598 0.598 O 0.402 0.402 0.402	730
Below is a description of a superconductor material.	The chemical formula is Sc2AlC . The Tc_supercon is 1.03. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.30 3.30 15.00 90 90 120 Sc 0.333 0.667 0.417 Sc 0.667 0.333 0.917 Sc 0.667 0.333 0.583 Sc 0.333 0.667 0.083 Al 0.667 0.333 0.250 Al 0.333 0.667 0.750 C 0.000 0.000 0.500 C 0.000 0.000 0.000	731
Below is a description of a superconductor material.	The chemical formula is SnGeO3 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.86 3.86 3.86 90 90 90 Sn 0.000 0.000 0.000 Ge 0.500 0.500 0.500 O 0.500 0.500 0.000 O 0.500 0.000 0.500 O 0.000 0.500 0.500	732
Below is a description of a superconductor material.	The chemical formula is AlVNi2 . The Tc_supercon is 5.88. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.68 2.68 6.73 90 90 90 Al 0.000 0.000 0.000 V 0.000 0.000 0.500 Ni 0.500 0.500 0.240 Ni 0.500 0.500 0.760	733
Below is a description of a superconductor material.	The chemical formula is BaScO2 . The Tc_supercon is 0.01. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.22 4.22 3.88 90 90 90 Ba 0.500 0.500 0.500 Sc 0.000 0.000 0.000 O 0.500 0.000 0.000 O 0.000 0.500 0.000	734
Below is a description of a superconductor material.	The chemical formula is ZnCo2Ge . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.06 4.06 4.06 60 60 60 Zn 0.500 0.500 0.500 Co 0.250 0.250 0.250 Co 0.750 0.750 0.750 Ge 0.000 0.000 0.000	735
Below is a description of a superconductor material.	The chemical formula is VI . The Tc_supercon is 7.34. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.37 3.37 3.37 90 90 90 V 0.500 0.500 0.500 I 0.000 0.000 0.000	736
Below is a description of a superconductor material.	The chemical formula is TaNF2 . The Tc_supercon is 1.04. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.96 2.96 5.72 90 90 90 Ta 0.500 0.500 0.750 N 0.000 0.000 0.782 F 0.000 0.000 0.404 F 0.500 0.500 0.074	737
Below is a description of a superconductor material.	The chemical formula is Mn3N2 . The Tc_supercon is 15.17. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.97 2.97 5.94 90 90 119 Mn 0.333 0.667 0.676 Mn 0.667 0.333 0.324 Mn 0.000 0.000 0.000 N 0.333 0.667 0.208 N 0.667 0.333 0.792	738
Below is a description of a superconductor material.	The chemical formula is SrMgH2 . The Tc_supercon is 8.59. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.42 3.42 5.41 90 90 90 Sr 0.500 0.500 0.537 Mg 0.000 0.000 0.014 H 0.000 0.000 0.373 H 0.500 0.500 0.087	739
Below is a description of a superconductor material.	The chemical formula is TiAsPd . The Tc_supercon is 1.69. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	6.62 6.62 3.80 90 90 120 Ti 0.596 0.000 0.000 Ti 0.000 0.596 0.000 Ti 0.404 0.404 0.000 As 0.333 0.667 0.500 As 0.667 0.333 0.500 As 0.000 0.000 0.000 Pd 0.264 0.000 0.500 Pd 0.000 0.264 0.500 Pd 0.736 0.736 0.500	740
Below is a description of a superconductor material.	The chemical formula is BaBrO . The Tc_supercon is 3.59. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.66 5.52 4.97 90 90 100 Ba 0.317 -0.098 0.000 Br 0.896 0.335 0.000 O 0.788 0.763 0.000	741
Below is a description of a superconductor material.	The chemical formula is ScAlCo2 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.21 4.21 4.21 60 60 60 Sc 0.750 0.750 0.750 Al 0.250 0.250 0.250 Co 0.500 0.500 0.500 Co 0.000 0.000 0.000	742
Below is a description of a superconductor material.	The chemical formula is ZrCo2 . The Tc_supercon is 4.44. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.87 4.87 4.87 60 60 60 Zr 0.750 0.750 0.750 Zr 0.000 0.000 0.000 Co 0.875 0.375 0.375 Co 0.375 0.875 0.375 Co 0.375 0.375 0.875 Co 0.375 0.375 0.375	743
Below is a description of a superconductor material.	The chemical formula is WO3 . The Tc_supercon is 1.8. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.84 3.84 3.84 90 90 90 W 0.000 0.000 0.000 O 0.000 0.500 0.000 O 0.500 0.000 0.000 O 0.000 0.000 0.500	744
Below is a description of a superconductor material.	The chemical formula is ScP . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.76 3.76 3.76 60 60 60 Sc 0.000 0.000 0.000 P 0.500 0.500 0.500	745
Below is a description of a superconductor material.	The chemical formula is NbSnO3 . The Tc_supercon is 3.84. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.13 4.13 4.07 90 90 90 Nb 0.500 0.500 0.638 Sn 0.000 0.000 0.027 O 0.000 0.500 0.673 O 0.500 0.000 0.673 O 0.500 0.500 0.150	746
Below is a description of a superconductor material.	The chemical formula is NaFe2O3 . The Tc_supercon is 10.52. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.88 2.88 7.65 90 90 120 Na 0.000 0.000 0.500 Fe 0.667 0.333 0.165 Fe 0.333 0.667 0.835 O 0.667 0.333 0.710 O 0.333 0.667 0.290 O 0.000 0.000 0.000	747
Below is a description of a superconductor material.	The chemical formula is FeS . The Tc_supercon is 12.73. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.33 5.20 5.60 90 90 90 Fe 0.750 0.985 0.207 Fe 0.250 0.015 0.793 Fe 0.750 0.485 0.293 Fe 0.250 0.515 0.707 S 0.750 0.782 0.582 S 0.250 0.218 0.418 S 0.750 0.282 0.918 S 0.250 0.718 0.082	748
Below is a description of a superconductor material.	The chemical formula is V3Ru . The Tc_supercon is 1.7. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.22 4.22 4.22 60 60 60 V 0.000 0.000 0.000 V 0.500 0.500 0.500 V 0.250 0.250 0.250 Ru 0.750 0.750 0.750	749
Below is a description of a superconductor material.	The chemical formula is AlPt3 . The Tc_supercon is 2.24. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.93 3.93 3.93 90 90 90 Al 0.000 0.000 0.000 Pt 0.000 0.500 0.500 Pt 0.500 0.500 0.000 Pt 0.500 0.000 0.500	750
Below is a description of a superconductor material.	The chemical formula is ScBe2Rh . The Tc_supercon is 4.17. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.92 2.92 6.07 90 90 90 Sc 0.500 0.500 0.500 Be 0.000 0.000 0.812 Be 0.000 0.000 0.188 Rh 0.500 0.500 0.000	751
Below is a description of a superconductor material.	The chemical formula is ScNi . The Tc_supercon is 0.08. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.15 3.15 3.15 90 90 90 Sc 0.500 0.500 0.500 Ni 0.000 0.000 0.000	752
Below is a description of a superconductor material.	The chemical formula is MnBe2Tc . The Tc_supercon is 2.04. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.90 3.90 3.90 120 120 89 Mn 0.500 0.500 0.000 Be 0.000 0.000 0.000 Be 0.250 0.750 0.500 Tc 0.750 0.250 0.500	753
Below is a description of a superconductor material.	The chemical formula is TiReN3 . The Tc_supercon is 20.04. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	5.11 5.11 5.57 62 62 60 Ti 0.994 0.994 0.017 Ti 0.494 0.494 0.517 Re 0.298 0.298 0.106 Re 0.798 0.798 0.606 N 0.411 0.071 0.811 N 0.707 0.411 0.811 N 0.911 0.207 0.311 N 0.571 0.911 0.311 N 0.071 0.707 0.811 N 0.207 0.571 0.311	754
Below is a description of a superconductor material.	The chemical formula is Nb3Ge . The Tc_supercon is 8.53. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	5.18 5.18 5.18 90 90 90 Nb 0.250 0.000 0.500 Nb 0.750 0.000 0.500 Nb 0.000 0.500 0.250 Nb 0.000 0.500 0.750 Nb 0.500 0.750 0.000 Nb 0.500 0.250 0.000 Ge 0.000 0.000 0.000 Ge 0.500 0.500 0.500	755
Below is a description of a superconductor material.	The chemical formula is SrNbO2 . The Tc_supercon is 0.55. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.15 4.15 3.43 90 90 90 Sr 0.500 0.500 0.500 Nb 0.000 0.000 0.000 O 0.500 0.000 0.000 O 0.000 0.500 0.000	756
Below is a description of a superconductor material.	The chemical formula is NbCl2 . The Tc_supercon is 2.76. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	6.59 3.09 4.78 90 133 90 Nb 0.633 0.000 0.133 Cl -0.367 0.000 -0.367 Cl 0.133 0.000 0.633	757
Below is a description of a superconductor material.	The chemical formula is TiSCl . The Tc_supercon is 8.2. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.45 3.45 4.82 90 90 90 Ti 0.500 0.500 0.000 S 0.000 0.000 0.000 Cl 0.500 0.500 0.500	758
Below is a description of a superconductor material.	The chemical formula is MgNbRu2 . The Tc_supercon is 0.19. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.44 4.44 4.44 60 60 60 Mg 0.250 0.250 0.250 Nb 0.750 0.750 0.750 Ru 0.000 0.000 0.000 Ru 0.500 0.500 0.500	759
Below is a description of a superconductor material.	The chemical formula is Be2CuIr . The Tc_supercon is 2.91. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.86 2.86 5.28 90 90 90 Be 0.000 0.000 0.007 Be 0.500 0.500 0.239 Cu 0.000 0.000 0.460 Ir 0.500 0.500 0.794	760
Below is a description of a superconductor material.	The chemical formula is NaYF2 . The Tc_supercon is 0.83. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.28 3.28 6.32 90 90 90 Na 0.500 0.500 0.503 Y 0.000 0.000 0.016 F 0.000 0.000 0.365 F 0.500 0.500 0.125	761
Below is a description of a superconductor material.	The chemical formula is SiNi . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.09 3.28 4.71 90 90 90 Si 0.000 0.000 0.840 Si 0.500 0.500 0.160 Ni 0.000 0.000 0.341 Ni 0.500 0.500 0.659	762
Below is a description of a superconductor material.	The chemical formula is TiOF2 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.85 2.85 5.56 90 90 90 Ti 0.500 0.500 0.265 O 0.000 0.000 0.208 F 0.000 0.000 0.589 F 0.500 0.500 0.948	763
Below is a description of a superconductor material.	The chemical formula is RbGaF3 . The Tc_supercon is 0.01. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.30 4.30 4.30 90 90 90 Rb 0.500 0.500 0.500 Ga 0.000 0.000 0.000 F 0.000 0.500 0.000 F 0.000 0.000 0.500 F 0.500 0.000 0.000	764
Below is a description of a superconductor material.	The chemical formula is ZrAl6Mo . The Tc_supercon is 2.92. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.89 3.89 8.71 90 90 90 Zr 0.500 0.500 0.500 Al 0.500 0.500 0.000 Al 0.000 0.000 0.500 Al 0.000 0.500 0.243 Al 0.500 0.000 0.757 Al 0.500 0.000 0.243 Al 0.000 0.500 0.757 Mo 0.000 0.000 0.000	765
Below is a description of a superconductor material.	The chemical formula is MgH2 . The Tc_supercon is 10.28. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.36 3.36 3.36 60 60 60 Mg 0.000 0.000 0.000 H 0.250 0.250 0.250 H 0.750 0.750 0.750	766
Below is a description of a superconductor material.	The chemical formula is ZrZnF2 . The Tc_supercon is 1.5. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.17 3.17 5.78 90 90 90 Zr 0.500 0.500 0.533 Zn 0.000 0.000 0.874 F 0.000 0.000 0.418 F 0.500 0.500 0.185	767
Below is a description of a superconductor material.	The chemical formula is MgTiF . The Tc_supercon is 4.36. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.87 2.87 6.71 90 90 90 Mg 0.000 0.000 0.299 Ti 0.000 0.000 0.721 F 0.000 0.000 0.010	768
Below is a description of a superconductor material.	The chemical formula is Ni3Sb . The Tc_supercon is 0.01. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.75 3.75 3.75 90 90 90 Ni 0.000 0.500 0.500 Ni 0.500 0.000 0.500 Ni 0.500 0.500 0.000 Sb 0.000 0.000 0.000	769
Below is a description of a superconductor material.	The chemical formula is ZrBe2 . The Tc_supercon is 13.62. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.81 3.81 3.26 90 90 120 Zr 0.000 0.000 0.000 Be 0.333 0.667 0.500 Be 0.667 0.333 0.500	770
Below is a description of a superconductor material.	The chemical formula is Ti2AlMo . The Tc_supercon is 1.69. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.49 4.49 4.49 60 60 60 Ti 0.000 0.000 0.000 Ti 0.500 0.500 0.500 Al 0.250 0.250 0.250 Mo 0.750 0.750 0.750	771
Below is a description of a superconductor material.	The chemical formula is MgAlNi2 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.16 4.16 4.16 60 60 60 Mg 0.000 0.000 0.000 Al 0.500 0.500 0.500 Ni 0.250 0.250 0.250 Ni 0.750 0.750 0.750	772
Below is a description of a superconductor material.	The chemical formula is NbF2 . The Tc_supercon is 6.28. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.62 4.19 4.19 89 89 89 Nb 0.032 0.174 0.794 F 0.032 0.174 0.294 F 0.032 0.674 0.794	773
Below is a description of a superconductor material.	The chemical formula is Sc3SnC . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.52 4.52 4.52 90 90 90 Sc 0.000 0.500 0.500 Sc 0.500 0.500 0.000 Sc 0.500 0.000 0.500 Sn 0.000 0.000 0.000 C 0.500 0.500 0.500	774
Below is a description of a superconductor material.	The chemical formula is VFeSe . The Tc_supercon is 6.12. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.92 3.92 3.92 60 60 60 V 0.500 0.500 0.500 Fe 0.250 0.250 0.250 Se 0.000 0.000 0.000	775
Below is a description of a superconductor material.	The chemical formula is LiGeO . The Tc_supercon is 5.52. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.68 3.68 5.88 90 90 90 Li 0.000 0.000 0.000 Li 0.500 0.500 0.000 Ge 0.000 0.500 0.556 Ge 0.500 0.000 0.444 O 0.000 0.500 0.865 O 0.500 0.000 0.135	776
Below is a description of a superconductor material.	The chemical formula is Sc2BeIr . The Tc_supercon is 6.22. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.04 3.04 7.34 90 90 90 Sc 0.000 0.000 0.942 Sc 0.500 0.500 0.307 Be 0.000 0.000 0.557 Ir 0.500 0.500 0.694	777
Below is a description of a superconductor material.	The chemical formula is BaNbO3 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.15 4.15 4.15 90 90 90 Ba 0.500 0.500 0.500 Nb 0.000 0.000 0.000 O 0.000 0.500 0.000 O 0.000 0.000 0.500 O 0.500 0.000 0.000	778
Below is a description of a superconductor material.	The chemical formula is TiC . The Tc_supercon is 1.78. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.07 3.07 3.07 60 60 60 Ti 0.000 0.000 0.000 C 0.500 0.500 0.500	779
Below is a description of a superconductor material.	The chemical formula is NbAlO3 . The Tc_supercon is 4.34. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.05 4.05 4.05 90 90 90 Nb 0.500 0.500 0.500 Al 0.000 0.000 0.000 O 0.000 0.500 0.500 O 0.500 0.000 0.500 O 0.500 0.500 0.000	780
Below is a description of a superconductor material.	The chemical formula is SiClF2 . The Tc_supercon is 2.39. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.16 3.16 6.71 90 90 90 Si 0.500 0.500 0.542 Cl 0.000 0.000 0.116 F 0.000 0.000 0.570 F 0.500 0.500 0.781	781
Below is a description of a superconductor material.	The chemical formula is BeSiNi2 . The Tc_supercon is 0.33. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.78 2.78 5.23 90 90 90 Be 0.000 0.000 0.000 Si 0.000 0.000 0.500 Ni 0.500 0.500 0.245 Ni 0.500 0.500 0.755	782
Below is a description of a superconductor material.	The chemical formula is Be2TcIr . The Tc_supercon is 2.31. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.98 3.98 3.98 120 120 89 Be 0.000 0.000 0.000 Be 0.500 0.500 0.000 Tc 0.750 0.250 0.500 Ir 0.250 0.750 0.500	783
Below is a description of a superconductor material.	The chemical formula is Ti3Si . The Tc_supercon is 10.49. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	5.62 5.62 4.52 90 90 120 Ti 0.171 0.342 0.250 Ti 0.658 0.829 0.250 Ti 0.171 0.829 0.250 Ti 0.829 0.658 0.750 Ti 0.342 0.171 0.750 Ti 0.829 0.171 0.750 Si 0.667 0.333 0.250 Si 0.333 0.667 0.750	784
Below is a description of a superconductor material.	The chemical formula is Zn2PtRh . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.31 4.31 4.31 60 60 60 Zn 0.000 0.000 0.000 Zn 0.500 0.500 0.500 Pt 0.250 0.250 0.250 Rh 0.750 0.750 0.750	785
Below is a description of a superconductor material.	The chemical formula is ScTaBe2 . The Tc_supercon is 1.75. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.38 4.38 2.94 90 90 90 Sc 0.500 0.500 0.500 Ta 0.000 0.000 0.500 Be 0.500 0.000 0.000 Be 0.000 0.500 0.000	786
Below is a description of a superconductor material.	The chemical formula is CrB2Mo . The Tc_supercon is 7.44. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.40 4.40 3.00 90 90 139 Cr 0.859 0.141 0.500 B 0.436 0.564 0.000 B 0.556 0.444 0.500 Mo 0.149 0.851 0.000	787
Below is a description of a superconductor material.	The chemical formula is LiP2 . The Tc_supercon is 11.8. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.90 2.62 4.26 90 89 90 Li 0.408 0.000 -0.033 P -0.101 0.000 -0.033 P 0.093 0.000 0.467	788
Below is a description of a superconductor material.	The chemical formula is ZnGaCo2 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.06 4.06 4.06 60 60 60 Zn 0.000 0.000 0.000 Ga 0.500 0.500 0.500 Co 0.750 0.750 0.750 Co 0.250 0.250 0.250	789
Below is a description of a superconductor material.	The chemical formula is NbRu . The Tc_supercon is 10.49. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.06 3.06 3.45 90 90 90 Nb 0.000 0.000 0.000 Ru 0.500 0.500 0.500	790
Below is a description of a superconductor material.	The chemical formula is GaCo . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.88 2.88 2.88 90 90 90 Ga 0.500 0.500 0.500 Co 0.000 0.000 0.000	791
Below is a description of a superconductor material.	The chemical formula is BeBr2 . The Tc_supercon is 2.11. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	5.00 5.00 3.95 90 90 120 Be 0.000 0.000 0.000 Br 0.333 0.667 0.000 Br 0.667 0.333 0.000	792
Below is a description of a superconductor material.	The chemical formula is VH2 . The Tc_supercon is 0.69. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.99 2.99 2.99 60 60 59 V 0.000 0.000 0.000 H 0.750 0.750 0.750 H 0.250 0.250 0.250	793
Below is a description of a superconductor material.	The chemical formula is K2Rh2O5 . The Tc_supercon is 12.89. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.86 3.86 8.50 90 90 90 K 0.000 0.000 0.000 K 0.000 0.000 0.500 Rh 0.500 0.500 0.266 Rh 0.500 0.500 0.734 O 0.500 0.000 0.228 O 0.500 0.000 0.772 O 0.500 0.500 0.500 O 0.000 0.500 0.228 O 0.000 0.500 0.772	794
Below is a description of a superconductor material.	The chemical formula is AlNi3 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.57 3.57 3.57 90 90 90 Al 0.000 0.000 0.000 Ni 0.000 0.500 0.500 Ni 0.500 0.000 0.500 Ni 0.500 0.500 0.000	795
Below is a description of a superconductor material.	The chemical formula is ScBeTc2 . The Tc_supercon is 8.83. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.33 4.33 4.33 119 119 90 Sc 0.750 0.250 0.500 Be 0.500 0.500 0.000 Tc 0.000 0.000 0.000 Tc 0.250 0.750 0.500	796
Below is a description of a superconductor material.	The chemical formula is BS . The Tc_supercon is 2.91. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.03 2.67 7.32 68 101 90 B 0.852 0.081 0.950 B 0.940 0.401 0.129 S 0.266 0.259 0.774 S 0.526 0.223 0.305	797
Below is a description of a superconductor material.	The chemical formula is ZrO . The Tc_supercon is 9.83. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.54 3.54 3.54 60 59 60 Zr 0.000 0.000 0.000 O 0.750 0.750 0.750	798
Below is a description of a superconductor material.	The chemical formula is AlCN . The Tc_supercon is 10.24. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.92 3.98 3.23 90 90 35 Al -0.254 0.084 0.000 C 0.246 0.227 0.000 N 0.246 -0.092 0.000	799

Below is a description of a superconductor material.

The chemical formula is BeSiRh2 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.06 4.06 4.06 60 60 60 Be 0.250 0.250 0.250 Si 0.750 0.750 0.750 Rh 0.000 0.000 0.000 Rh 0.500 0.500 0.500

700

Below is a description of a superconductor material.

The chemical formula is LiFeP . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.69 3.69 5.83 90 90 90 Li 0.500 0.000 0.654 Li 0.000 0.500 0.346 Fe 0.500 0.500 0.000 Fe 0.000 0.000 0.000 P 0.000 0.500 0.789 P 0.500 0.000 0.211

701

Below is a description of a superconductor material.

The chemical formula is ScBRh3 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.12 4.12 4.12 90 90 90 Sc 0.000 0.000 0.000 B 0.500 0.500 0.500 Rh 0.000 0.500 0.500 Rh 0.500 0.000 0.500 Rh 0.500 0.500 0.000

702

Below is a description of a superconductor material.

The chemical formula is Be4FeGe . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.24 4.24 4.24 59 59 60 Be 0.624 0.624 0.129 Be 0.624 0.129 0.624 Be 0.129 0.624 0.624 Be 0.624 0.624 0.624 Fe 0.250 0.250 0.250 Ge 0.000 0.000 0.000

703

Below is a description of a superconductor material.

The chemical formula is B2Mo . The Tc_supercon is 13.7. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.02 3.02 3.38 90 90 120 B 0.333 0.667 0.500 B 0.667 0.333 0.500 Mo 0.000 0.000 0.000

704

Below is a description of a superconductor material.

The chemical formula is ScGaCu2 . The Tc_supercon is 2.44. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.37 4.37 4.37 60 60 60 Sc 0.500 0.500 0.500 Ga 0.000 0.000 0.000 Cu 0.750 0.750 0.750 Cu 0.250 0.250 0.250

705

Below is a description of a superconductor material.

The chemical formula is NiMoP2 . The Tc_supercon is 0.22. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.36 3.36 11.25 90 90 120 Ni 0.000 0.000 0.000 Ni 0.000 0.000 0.500 Mo 0.000 0.000 0.250 Mo 0.000 0.000 0.750 P 0.333 0.667 0.613 P 0.667 0.333 0.113 P 0.333 0.667 0.887 P 0.667 0.333 0.387

706

Below is a description of a superconductor material.

The chemical formula is Co3W . The Tc_supercon is 0.09. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.59 3.59 3.59 90 90 90 Co 0.500 0.500 0.000 Co 0.500 0.000 0.500 Co 0.000 0.500 0.500 W 0.000 0.000 0.000

707

Below is a description of a superconductor material.

The chemical formula is TiB2Mo . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.52 4.52 3.08 90 90 138 Ti 0.852 0.148 0.000 B 0.442 0.558 0.500 B 0.559 0.441 0.000 Mo 0.147 0.853 0.500

708

Below is a description of a superconductor material.

The chemical formula is Sc2IrRu . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.54 4.54 4.54 60 60 60 Sc 0.000 0.000 0.000 Sc 0.500 0.500 0.500 Ir 0.250 0.250 0.250 Ru 0.750 0.750 0.750

709

Below is a description of a superconductor material.

The chemical formula is V2InC . The Tc_supercon is 0.63. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.04 3.04 13.52 90 90 119 V 0.333 0.667 0.078 V 0.333 0.667 0.422 V 0.667 0.333 0.578 V 0.667 0.333 0.922 In 0.333 0.667 0.750 In 0.667 0.333 0.250 C 0.000 0.000 0.000 C 0.000 0.000 0.500

710

Below is a description of a superconductor material.

The chemical formula is Ti2AlCr . The Tc_supercon is 6.44. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.12 3.12 6.18 90 90 90 Ti 0.500 0.500 0.277 Ti 0.500 0.500 0.723 Al 0.000 0.000 0.000 Cr 0.000 0.000 0.500

711

Below is a description of a superconductor material.

The chemical formula is AsHO . The Tc_supercon is 19.92. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.60 3.60 4.99 90 90 90 As 0.500 0.000 0.267 As 0.000 0.500 0.733 H 0.000 0.000 0.000 H 0.500 0.500 0.000 O 0.000 0.000 0.500 O 0.500 0.500 0.500

712

Below is a description of a superconductor material.

The chemical formula is Sc2CoRu . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.46 4.46 4.46 60 60 60 Sc 0.000 0.000 0.000 Sc 0.500 0.500 0.500 Co 0.250 0.250 0.250 Ru 0.750 0.750 0.750

713

Below is a description of a superconductor material.

The chemical formula is GaGeRu2 . The Tc_supercon is 3.64. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.29 4.29 4.29 60 60 60 Ga 0.250 0.250 0.250 Ge 0.750 0.750 0.750 Ru 0.000 0.000 0.000 Ru 0.500 0.500 0.500

714

Below is a description of a superconductor material.

The chemical formula is TiBe2Ge . The Tc_supercon is 0.25. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.65 3.65 3.60 90 90 90 Ti 0.000 0.000 0.500 Be 0.500 0.000 0.000 Be 0.000 0.500 0.000 Ge 0.500 0.500 0.500

715

Below is a description of a superconductor material.

The chemical formula is CoN . The Tc_supercon is 14.5. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.01 3.01 3.01 60 60 60 Co 0.000 0.000 0.000 N 0.250 0.250 0.250

716

Below is a description of a superconductor material.

The chemical formula is Be2RuRh . The Tc_supercon is 3.5. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

9.54 6.75 6.75 34 19 19 Be 0.748 0.001 0.001 Be 0.252 -0.001 -0.001 Ru -0.000 0.000 0.000 Rh 0.500 -0.000 -0.000

717

Below is a description of a superconductor material.

The chemical formula is KP . The Tc_supercon is 0.96. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.28 3.02 4.98 90 90 45 K 0.057 0.906 0.917 P 0.557 0.906 0.417

718

Below is a description of a superconductor material.

The chemical formula is NbRh3 . The Tc_supercon is 0.1. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.90 3.90 3.90 90 90 90 Nb 0.000 0.000 0.000 Rh 0.000 0.500 0.500 Rh 0.500 0.500 0.000 Rh 0.500 0.000 0.500

719

Below is a description of a superconductor material.

The chemical formula is Mn3RhN . The Tc_supercon is 10.13. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.76 3.76 3.76 90 90 90 Mn 0.500 0.500 0.000 Mn 0.500 0.000 0.500 Mn 0.000 0.500 0.500 Rh 0.000 0.000 0.000 N 0.500 0.500 0.500

720

Below is a description of a superconductor material.

The chemical formula is MgBe2Pd . The Tc_supercon is 4.42. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.09 4.09 4.09 119 119 90 Mg 0.250 0.750 0.500 Be 0.000 0.000 0.000 Be 0.500 0.500 0.000 Pd 0.750 0.250 0.500

721

Below is a description of a superconductor material.

The chemical formula is YSiO3 . The Tc_supercon is 7.36. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.70 3.70 3.70 90 90 90 Y 0.000 0.000 0.000 Si 0.500 0.500 0.500 O 0.500 0.500 0.000 O 0.500 0.000 0.500 O 0.000 0.500 0.500

722

Below is a description of a superconductor material.

The chemical formula is TiSi . The Tc_supercon is 5.64. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.64 4.74 4.74 53 67 67 Ti 0.500 0.449 0.551 Ti -0.000 0.949 0.051 Si 0.750 0.699 0.801 Si 0.250 0.199 0.301

723

Below is a description of a superconductor material.

The chemical formula is TaTiOs2 . The Tc_supercon is 6.62. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.45 4.45 4.45 60 60 60 Ta 0.250 0.250 0.250 Ti 0.750 0.750 0.750 Os 0.000 0.000 0.000 Os 0.500 0.500 0.500

724

Below is a description of a superconductor material.

The chemical formula is ScC . The Tc_supercon is 3.93. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.31 3.31 3.31 60 60 60 Sc 0.000 0.000 0.000 C 0.500 0.500 0.500

725

Below is a description of a superconductor material.

The chemical formula is VRu . The Tc_supercon is 20.26. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.01 3.01 3.01 90 90 90 V 0.500 0.500 0.500 Ru 0.000 0.000 0.000

726

Below is a description of a superconductor material.

The chemical formula is NbN . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.98 2.98 2.91 90 90 119 Nb 0.333 0.667 0.500 N 0.000 0.000 0.000

727

Below is a description of a superconductor material.

The chemical formula is TaCo3 . The Tc_supercon is 0.01. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.14 5.16 5.16 120 90 90 Ta 0.750 0.667 0.333 Ta 0.250 0.333 0.667 Co 0.750 0.158 0.316 Co 0.750 0.158 0.842 Co 0.750 0.684 0.842 Co 0.250 0.842 0.684 Co 0.250 0.842 0.158 Co 0.250 0.316 0.158

728

Below is a description of a superconductor material.

The chemical formula is AlSbO . The Tc_supercon is 7.49. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.13 3.13 6.83 90 90 90 Al 0.000 0.000 0.432 Sb 0.000 0.000 -0.029 O 0.000 0.000 0.681

729

Below is a description of a superconductor material.

The chemical formula is CoO2 . The Tc_supercon is 16.15. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.75 4.75 4.75 34 34 34 Co 0.000 0.000 0.000 O 0.598 0.598 0.598 O 0.402 0.402 0.402

730

Below is a description of a superconductor material.

The chemical formula is Sc2AlC . The Tc_supercon is 1.03. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.30 3.30 15.00 90 90 120 Sc 0.333 0.667 0.417 Sc 0.667 0.333 0.917 Sc 0.667 0.333 0.583 Sc 0.333 0.667 0.083 Al 0.667 0.333 0.250 Al 0.333 0.667 0.750 C 0.000 0.000 0.500 C 0.000 0.000 0.000

731

Below is a description of a superconductor material.

The chemical formula is SnGeO3 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.86 3.86 3.86 90 90 90 Sn 0.000 0.000 0.000 Ge 0.500 0.500 0.500 O 0.500 0.500 0.000 O 0.500 0.000 0.500 O 0.000 0.500 0.500

732

Below is a description of a superconductor material.

The chemical formula is AlVNi2 . The Tc_supercon is 5.88. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.68 2.68 6.73 90 90 90 Al 0.000 0.000 0.000 V 0.000 0.000 0.500 Ni 0.500 0.500 0.240 Ni 0.500 0.500 0.760

733

Below is a description of a superconductor material.

The chemical formula is BaScO2 . The Tc_supercon is 0.01. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.22 4.22 3.88 90 90 90 Ba 0.500 0.500 0.500 Sc 0.000 0.000 0.000 O 0.500 0.000 0.000 O 0.000 0.500 0.000

734

Below is a description of a superconductor material.

The chemical formula is ZnCo2Ge . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.06 4.06 4.06 60 60 60 Zn 0.500 0.500 0.500 Co 0.250 0.250 0.250 Co 0.750 0.750 0.750 Ge 0.000 0.000 0.000

735

Below is a description of a superconductor material.

The chemical formula is VI . The Tc_supercon is 7.34. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.37 3.37 3.37 90 90 90 V 0.500 0.500 0.500 I 0.000 0.000 0.000

736

Below is a description of a superconductor material.

The chemical formula is TaNF2 . The Tc_supercon is 1.04. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.96 2.96 5.72 90 90 90 Ta 0.500 0.500 0.750 N 0.000 0.000 0.782 F 0.000 0.000 0.404 F 0.500 0.500 0.074

737

Below is a description of a superconductor material.

The chemical formula is Mn3N2 . The Tc_supercon is 15.17. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.97 2.97 5.94 90 90 119 Mn 0.333 0.667 0.676 Mn 0.667 0.333 0.324 Mn 0.000 0.000 0.000 N 0.333 0.667 0.208 N 0.667 0.333 0.792

738

Below is a description of a superconductor material.

The chemical formula is SrMgH2 . The Tc_supercon is 8.59. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.42 3.42 5.41 90 90 90 Sr 0.500 0.500 0.537 Mg 0.000 0.000 0.014 H 0.000 0.000 0.373 H 0.500 0.500 0.087

739

Below is a description of a superconductor material.

The chemical formula is TiAsPd . The Tc_supercon is 1.69. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

6.62 6.62 3.80 90 90 120 Ti 0.596 0.000 0.000 Ti 0.000 0.596 0.000 Ti 0.404 0.404 0.000 As 0.333 0.667 0.500 As 0.667 0.333 0.500 As 0.000 0.000 0.000 Pd 0.264 0.000 0.500 Pd 0.000 0.264 0.500 Pd 0.736 0.736 0.500

740

Below is a description of a superconductor material.

The chemical formula is BaBrO . The Tc_supercon is 3.59. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.66 5.52 4.97 90 90 100 Ba 0.317 -0.098 0.000 Br 0.896 0.335 0.000 O 0.788 0.763 0.000

741

Below is a description of a superconductor material.

The chemical formula is ScAlCo2 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.21 4.21 4.21 60 60 60 Sc 0.750 0.750 0.750 Al 0.250 0.250 0.250 Co 0.500 0.500 0.500 Co 0.000 0.000 0.000

742

Below is a description of a superconductor material.

The chemical formula is ZrCo2 . The Tc_supercon is 4.44. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.87 4.87 4.87 60 60 60 Zr 0.750 0.750 0.750 Zr 0.000 0.000 0.000 Co 0.875 0.375 0.375 Co 0.375 0.875 0.375 Co 0.375 0.375 0.875 Co 0.375 0.375 0.375

743

Below is a description of a superconductor material.

The chemical formula is WO3 . The Tc_supercon is 1.8. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.84 3.84 3.84 90 90 90 W 0.000 0.000 0.000 O 0.000 0.500 0.000 O 0.500 0.000 0.000 O 0.000 0.000 0.500

744

Below is a description of a superconductor material.

The chemical formula is ScP . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.76 3.76 3.76 60 60 60 Sc 0.000 0.000 0.000 P 0.500 0.500 0.500

745

Below is a description of a superconductor material.

The chemical formula is NbSnO3 . The Tc_supercon is 3.84. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.13 4.13 4.07 90 90 90 Nb 0.500 0.500 0.638 Sn 0.000 0.000 0.027 O 0.000 0.500 0.673 O 0.500 0.000 0.673 O 0.500 0.500 0.150

746

Below is a description of a superconductor material.

The chemical formula is NaFe2O3 . The Tc_supercon is 10.52. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.88 2.88 7.65 90 90 120 Na 0.000 0.000 0.500 Fe 0.667 0.333 0.165 Fe 0.333 0.667 0.835 O 0.667 0.333 0.710 O 0.333 0.667 0.290 O 0.000 0.000 0.000

747

Below is a description of a superconductor material.

The chemical formula is FeS . The Tc_supercon is 12.73. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.33 5.20 5.60 90 90 90 Fe 0.750 0.985 0.207 Fe 0.250 0.015 0.793 Fe 0.750 0.485 0.293 Fe 0.250 0.515 0.707 S 0.750 0.782 0.582 S 0.250 0.218 0.418 S 0.750 0.282 0.918 S 0.250 0.718 0.082

748

Below is a description of a superconductor material.

The chemical formula is V3Ru . The Tc_supercon is 1.7. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.22 4.22 4.22 60 60 60 V 0.000 0.000 0.000 V 0.500 0.500 0.500 V 0.250 0.250 0.250 Ru 0.750 0.750 0.750

749

Below is a description of a superconductor material.

The chemical formula is AlPt3 . The Tc_supercon is 2.24. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.93 3.93 3.93 90 90 90 Al 0.000 0.000 0.000 Pt 0.000 0.500 0.500 Pt 0.500 0.500 0.000 Pt 0.500 0.000 0.500

750

Below is a description of a superconductor material.

The chemical formula is ScBe2Rh . The Tc_supercon is 4.17. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.92 2.92 6.07 90 90 90 Sc 0.500 0.500 0.500 Be 0.000 0.000 0.812 Be 0.000 0.000 0.188 Rh 0.500 0.500 0.000

751

Below is a description of a superconductor material.

The chemical formula is ScNi . The Tc_supercon is 0.08. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.15 3.15 3.15 90 90 90 Sc 0.500 0.500 0.500 Ni 0.000 0.000 0.000

752

Below is a description of a superconductor material.

The chemical formula is MnBe2Tc . The Tc_supercon is 2.04. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.90 3.90 3.90 120 120 89 Mn 0.500 0.500 0.000 Be 0.000 0.000 0.000 Be 0.250 0.750 0.500 Tc 0.750 0.250 0.500

753

Below is a description of a superconductor material.

The chemical formula is TiReN3 . The Tc_supercon is 20.04. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

5.11 5.11 5.57 62 62 60 Ti 0.994 0.994 0.017 Ti 0.494 0.494 0.517 Re 0.298 0.298 0.106 Re 0.798 0.798 0.606 N 0.411 0.071 0.811 N 0.707 0.411 0.811 N 0.911 0.207 0.311 N 0.571 0.911 0.311 N 0.071 0.707 0.811 N 0.207 0.571 0.311

754

Below is a description of a superconductor material.

The chemical formula is Nb3Ge . The Tc_supercon is 8.53. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

5.18 5.18 5.18 90 90 90 Nb 0.250 0.000 0.500 Nb 0.750 0.000 0.500 Nb 0.000 0.500 0.250 Nb 0.000 0.500 0.750 Nb 0.500 0.750 0.000 Nb 0.500 0.250 0.000 Ge 0.000 0.000 0.000 Ge 0.500 0.500 0.500

755

Below is a description of a superconductor material.

The chemical formula is SrNbO2 . The Tc_supercon is 0.55. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.15 4.15 3.43 90 90 90 Sr 0.500 0.500 0.500 Nb 0.000 0.000 0.000 O 0.500 0.000 0.000 O 0.000 0.500 0.000

756

Below is a description of a superconductor material.

The chemical formula is NbCl2 . The Tc_supercon is 2.76. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

6.59 3.09 4.78 90 133 90 Nb 0.633 0.000 0.133 Cl -0.367 0.000 -0.367 Cl 0.133 0.000 0.633

757

Below is a description of a superconductor material.

The chemical formula is TiSCl . The Tc_supercon is 8.2. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.45 3.45 4.82 90 90 90 Ti 0.500 0.500 0.000 S 0.000 0.000 0.000 Cl 0.500 0.500 0.500

758

Below is a description of a superconductor material.

The chemical formula is MgNbRu2 . The Tc_supercon is 0.19. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.44 4.44 4.44 60 60 60 Mg 0.250 0.250 0.250 Nb 0.750 0.750 0.750 Ru 0.000 0.000 0.000 Ru 0.500 0.500 0.500

759

Below is a description of a superconductor material.

The chemical formula is Be2CuIr . The Tc_supercon is 2.91. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.86 2.86 5.28 90 90 90 Be 0.000 0.000 0.007 Be 0.500 0.500 0.239 Cu 0.000 0.000 0.460 Ir 0.500 0.500 0.794

760

Below is a description of a superconductor material.

The chemical formula is NaYF2 . The Tc_supercon is 0.83. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.28 3.28 6.32 90 90 90 Na 0.500 0.500 0.503 Y 0.000 0.000 0.016 F 0.000 0.000 0.365 F 0.500 0.500 0.125

761

Below is a description of a superconductor material.

The chemical formula is SiNi . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.09 3.28 4.71 90 90 90 Si 0.000 0.000 0.840 Si 0.500 0.500 0.160 Ni 0.000 0.000 0.341 Ni 0.500 0.500 0.659

762

Below is a description of a superconductor material.

The chemical formula is TiOF2 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.85 2.85 5.56 90 90 90 Ti 0.500 0.500 0.265 O 0.000 0.000 0.208 F 0.000 0.000 0.589 F 0.500 0.500 0.948

763

Below is a description of a superconductor material.

The chemical formula is RbGaF3 . The Tc_supercon is 0.01. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.30 4.30 4.30 90 90 90 Rb 0.500 0.500 0.500 Ga 0.000 0.000 0.000 F 0.000 0.500 0.000 F 0.000 0.000 0.500 F 0.500 0.000 0.000

764

Below is a description of a superconductor material.

The chemical formula is ZrAl6Mo . The Tc_supercon is 2.92. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.89 3.89 8.71 90 90 90 Zr 0.500 0.500 0.500 Al 0.500 0.500 0.000 Al 0.000 0.000 0.500 Al 0.000 0.500 0.243 Al 0.500 0.000 0.757 Al 0.500 0.000 0.243 Al 0.000 0.500 0.757 Mo 0.000 0.000 0.000

765

Below is a description of a superconductor material.

The chemical formula is MgH2 . The Tc_supercon is 10.28. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.36 3.36 3.36 60 60 60 Mg 0.000 0.000 0.000 H 0.250 0.250 0.250 H 0.750 0.750 0.750

766

Below is a description of a superconductor material.

The chemical formula is ZrZnF2 . The Tc_supercon is 1.5. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.17 3.17 5.78 90 90 90 Zr 0.500 0.500 0.533 Zn 0.000 0.000 0.874 F 0.000 0.000 0.418 F 0.500 0.500 0.185

767

Below is a description of a superconductor material.

The chemical formula is MgTiF . The Tc_supercon is 4.36. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.87 2.87 6.71 90 90 90 Mg 0.000 0.000 0.299 Ti 0.000 0.000 0.721 F 0.000 0.000 0.010

768

Below is a description of a superconductor material.

The chemical formula is Ni3Sb . The Tc_supercon is 0.01. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.75 3.75 3.75 90 90 90 Ni 0.000 0.500 0.500 Ni 0.500 0.000 0.500 Ni 0.500 0.500 0.000 Sb 0.000 0.000 0.000

769

Below is a description of a superconductor material.

The chemical formula is ZrBe2 . The Tc_supercon is 13.62. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.81 3.81 3.26 90 90 120 Zr 0.000 0.000 0.000 Be 0.333 0.667 0.500 Be 0.667 0.333 0.500

770

Below is a description of a superconductor material.

The chemical formula is Ti2AlMo . The Tc_supercon is 1.69. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.49 4.49 4.49 60 60 60 Ti 0.000 0.000 0.000 Ti 0.500 0.500 0.500 Al 0.250 0.250 0.250 Mo 0.750 0.750 0.750

771

Below is a description of a superconductor material.

The chemical formula is MgAlNi2 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.16 4.16 4.16 60 60 60 Mg 0.000 0.000 0.000 Al 0.500 0.500 0.500 Ni 0.250 0.250 0.250 Ni 0.750 0.750 0.750

772

Below is a description of a superconductor material.

The chemical formula is NbF2 . The Tc_supercon is 6.28. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.62 4.19 4.19 89 89 89 Nb 0.032 0.174 0.794 F 0.032 0.174 0.294 F 0.032 0.674 0.794

773

Below is a description of a superconductor material.

The chemical formula is Sc3SnC . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.52 4.52 4.52 90 90 90 Sc 0.000 0.500 0.500 Sc 0.500 0.500 0.000 Sc 0.500 0.000 0.500 Sn 0.000 0.000 0.000 C 0.500 0.500 0.500

774

Below is a description of a superconductor material.

The chemical formula is VFeSe . The Tc_supercon is 6.12. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.92 3.92 3.92 60 60 60 V 0.500 0.500 0.500 Fe 0.250 0.250 0.250 Se 0.000 0.000 0.000

775

Below is a description of a superconductor material.

The chemical formula is LiGeO . The Tc_supercon is 5.52. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.68 3.68 5.88 90 90 90 Li 0.000 0.000 0.000 Li 0.500 0.500 0.000 Ge 0.000 0.500 0.556 Ge 0.500 0.000 0.444 O 0.000 0.500 0.865 O 0.500 0.000 0.135

776

Below is a description of a superconductor material.

The chemical formula is Sc2BeIr . The Tc_supercon is 6.22. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.04 3.04 7.34 90 90 90 Sc 0.000 0.000 0.942 Sc 0.500 0.500 0.307 Be 0.000 0.000 0.557 Ir 0.500 0.500 0.694

777

Below is a description of a superconductor material.

The chemical formula is BaNbO3 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.15 4.15 4.15 90 90 90 Ba 0.500 0.500 0.500 Nb 0.000 0.000 0.000 O 0.000 0.500 0.000 O 0.000 0.000 0.500 O 0.500 0.000 0.000

778

Below is a description of a superconductor material.

The chemical formula is TiC . The Tc_supercon is 1.78. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.07 3.07 3.07 60 60 60 Ti 0.000 0.000 0.000 C 0.500 0.500 0.500

779

Below is a description of a superconductor material.

The chemical formula is NbAlO3 . The Tc_supercon is 4.34. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.05 4.05 4.05 90 90 90 Nb 0.500 0.500 0.500 Al 0.000 0.000 0.000 O 0.000 0.500 0.500 O 0.500 0.000 0.500 O 0.500 0.500 0.000

780

Below is a description of a superconductor material.

The chemical formula is SiClF2 . The Tc_supercon is 2.39. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.16 3.16 6.71 90 90 90 Si 0.500 0.500 0.542 Cl 0.000 0.000 0.116 F 0.000 0.000 0.570 F 0.500 0.500 0.781

781

Below is a description of a superconductor material.

The chemical formula is BeSiNi2 . The Tc_supercon is 0.33. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.78 2.78 5.23 90 90 90 Be 0.000 0.000 0.000 Si 0.000 0.000 0.500 Ni 0.500 0.500 0.245 Ni 0.500 0.500 0.755

782

Below is a description of a superconductor material.

The chemical formula is Be2TcIr . The Tc_supercon is 2.31. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.98 3.98 3.98 120 120 89 Be 0.000 0.000 0.000 Be 0.500 0.500 0.000 Tc 0.750 0.250 0.500 Ir 0.250 0.750 0.500

783

Below is a description of a superconductor material.

The chemical formula is Ti3Si . The Tc_supercon is 10.49. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

5.62 5.62 4.52 90 90 120 Ti 0.171 0.342 0.250 Ti 0.658 0.829 0.250 Ti 0.171 0.829 0.250 Ti 0.829 0.658 0.750 Ti 0.342 0.171 0.750 Ti 0.829 0.171 0.750 Si 0.667 0.333 0.250 Si 0.333 0.667 0.750

784

Below is a description of a superconductor material.

The chemical formula is Zn2PtRh . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.31 4.31 4.31 60 60 60 Zn 0.000 0.000 0.000 Zn 0.500 0.500 0.500 Pt 0.250 0.250 0.250 Rh 0.750 0.750 0.750

785

Below is a description of a superconductor material.

The chemical formula is ScTaBe2 . The Tc_supercon is 1.75. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.38 4.38 2.94 90 90 90 Sc 0.500 0.500 0.500 Ta 0.000 0.000 0.500 Be 0.500 0.000 0.000 Be 0.000 0.500 0.000

786

Below is a description of a superconductor material.

The chemical formula is CrB2Mo . The Tc_supercon is 7.44. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.40 4.40 3.00 90 90 139 Cr 0.859 0.141 0.500 B 0.436 0.564 0.000 B 0.556 0.444 0.500 Mo 0.149 0.851 0.000

787

Below is a description of a superconductor material.

The chemical formula is LiP2 . The Tc_supercon is 11.8. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.90 2.62 4.26 90 89 90 Li 0.408 0.000 -0.033 P -0.101 0.000 -0.033 P 0.093 0.000 0.467

788

Below is a description of a superconductor material.

The chemical formula is ZnGaCo2 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.06 4.06 4.06 60 60 60 Zn 0.000 0.000 0.000 Ga 0.500 0.500 0.500 Co 0.750 0.750 0.750 Co 0.250 0.250 0.250

789

Below is a description of a superconductor material.

The chemical formula is NbRu . The Tc_supercon is 10.49. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.06 3.06 3.45 90 90 90 Nb 0.000 0.000 0.000 Ru 0.500 0.500 0.500

790

Below is a description of a superconductor material.

The chemical formula is GaCo . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.88 2.88 2.88 90 90 90 Ga 0.500 0.500 0.500 Co 0.000 0.000 0.000

791

Below is a description of a superconductor material.

The chemical formula is BeBr2 . The Tc_supercon is 2.11. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

5.00 5.00 3.95 90 90 120 Be 0.000 0.000 0.000 Br 0.333 0.667 0.000 Br 0.667 0.333 0.000

792

Below is a description of a superconductor material.

The chemical formula is VH2 . The Tc_supercon is 0.69. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.99 2.99 2.99 60 60 59 V 0.000 0.000 0.000 H 0.750 0.750 0.750 H 0.250 0.250 0.250

793

Below is a description of a superconductor material.

The chemical formula is K2Rh2O5 . The Tc_supercon is 12.89. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.86 3.86 8.50 90 90 90 K 0.000 0.000 0.000 K 0.000 0.000 0.500 Rh 0.500 0.500 0.266 Rh 0.500 0.500 0.734 O 0.500 0.000 0.228 O 0.500 0.000 0.772 O 0.500 0.500 0.500 O 0.000 0.500 0.228 O 0.000 0.500 0.772

794

Below is a description of a superconductor material.

The chemical formula is AlNi3 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.57 3.57 3.57 90 90 90 Al 0.000 0.000 0.000 Ni 0.000 0.500 0.500 Ni 0.500 0.000 0.500 Ni 0.500 0.500 0.000

795

Below is a description of a superconductor material.

The chemical formula is ScBeTc2 . The Tc_supercon is 8.83. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.33 4.33 4.33 119 119 90 Sc 0.750 0.250 0.500 Be 0.500 0.500 0.000 Tc 0.000 0.000 0.000 Tc 0.250 0.750 0.500

796

Below is a description of a superconductor material.

The chemical formula is BS . The Tc_supercon is 2.91. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.03 2.67 7.32 68 101 90 B 0.852 0.081 0.950 B 0.940 0.401 0.129 S 0.266 0.259 0.774 S 0.526 0.223 0.305

797

Below is a description of a superconductor material.

The chemical formula is ZrO . The Tc_supercon is 9.83. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.54 3.54 3.54 60 59 60 Zr 0.000 0.000 0.000 O 0.750 0.750 0.750

798

Below is a description of a superconductor material.

The chemical formula is AlCN . The Tc_supercon is 10.24. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.92 3.98 3.23 90 90 35 Al -0.254 0.084 0.000 C 0.246 0.227 0.000 N 0.246 -0.092 0.000

799