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 MgBeBr . The Tc_supercon is 1.68. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	6.00 3.56 3.63 90 90 90 Mg -0.228 0.424 0.000 Be 0.062 -0.076 0.000 Br 0.415 -0.076 0.000	600
Below is a description of a superconductor material.	The chemical formula is MnN . The Tc_supercon is 20.59. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.62 2.67 5.20 90 90 89 Mn 0.499 0.876 0.060 Mn 0.499 0.376 0.639 N 0.499 0.876 0.404 N 0.999 0.376 0.927	601
Below is a description of a superconductor material.	The chemical formula is LiBN . The Tc_supercon is 14.28. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.18 3.18 3.18 60 60 60 Li 0.750 0.750 0.750 B 0.250 0.250 0.250 N 0.000 0.000 0.000	602
Below is a description of a superconductor material.	The chemical formula is Sc . The Tc_supercon is 1.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.29 3.29 5.10 90 90 120 Sc 0.333 0.667 0.250 Sc 0.667 0.333 0.750	603
Below is a description of a superconductor material.	The chemical formula is HfO . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.04 3.04 5.47 90 90 90 Hf 0.000 0.000 0.230 Hf 0.500 0.500 0.770 O 0.000 0.000 0.648 O 0.500 0.500 0.352	604
Below is a description of a superconductor material.	The chemical formula is ScMo3O8 . The Tc_supercon is 2.64. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.84 5.74 5.74 119 89 90 Sc 0.265 0.676 0.325 Mo 0.747 0.148 0.852 Mo 0.743 0.691 0.837 Mo 0.743 0.163 0.309 O 0.530 0.008 0.508 O 0.952 0.332 0.668 O -0.005 0.832 0.665 O 0.976 0.836 0.164 O 0.530 0.493 0.992 O 0.461 -0.013 0.014 O 0.522 0.500 0.500 O 0.995 0.336 0.168	605
Below is a description of a superconductor material.	The chemical formula is Cr3GaN . The Tc_supercon is 10.86. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.82 3.82 3.82 90 90 90 Cr 0.500 0.000 0.500 Cr 0.000 0.500 0.500 Cr 0.500 0.500 0.000 Ga 0.000 0.000 0.000 N 0.500 0.500 0.500	606
Below is a description of a superconductor material.	The chemical formula is HfBeZn2 . The Tc_supercon is 3.31. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.91 2.91 6.99 90 90 90 Hf 0.500 0.500 0.724 Be 0.000 0.000 0.468 Zn 0.000 0.000 0.025 Zn 0.500 0.500 0.283	607
Below is a description of a superconductor material.	The chemical formula is TiAlO3 . The Tc_supercon is 0.88. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.86 3.86 3.86 90 90 90 Ti 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	608
Below is a description of a superconductor material.	The chemical formula is YAu . The Tc_supercon is 3.07. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.59 3.59 3.59 90 90 90 Y 0.500 0.500 0.500 Au 0.000 0.000 0.000	609
Below is a description of a superconductor material.	The chemical formula is AlCo2Si2 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.94 3.94 4.65 90 90 120 Al 0.000 0.000 0.000 Co 0.333 0.667 0.836 Co 0.667 0.333 0.164 Si 0.667 0.333 0.653 Si 0.333 0.667 0.347	610
Below is a description of a superconductor material.	The chemical formula is ZrN . The Tc_supercon is 2.44. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.21 3.21 5.70 90 90 120 Zr 0.000 0.000 0.500 Zr 0.000 0.000 0.000 N 0.333 0.667 0.250 N 0.667 0.333 0.750	611
Below is a description of a superconductor material.	The chemical formula is V3Ge . The Tc_supercon is 15.42. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.76 4.76 4.76 90 90 90 V 0.000 0.500 0.750 V 0.500 0.250 0.000 V 0.750 0.000 0.500 V 0.000 0.500 0.250 V 0.500 0.750 0.000 V 0.250 0.000 0.500 Ge 0.500 0.500 0.500 Ge 0.000 0.000 0.000	612
Below is a description of a superconductor material.	The chemical formula is MnRh . The Tc_supercon is 8.64. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.94 2.94 2.94 90 90 90 Mn 0.000 0.000 0.000 Rh 0.500 0.500 0.500	613
Below is a description of a superconductor material.	The chemical formula is VTe . The Tc_supercon is 11.34. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.32 3.32 3.32 90 90 90 V 0.500 0.500 0.500 Te 0.000 0.000 0.000	614
Below is a description of a superconductor material.	The chemical formula is CaCO3 . The Tc_supercon is 7.78. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.52 3.52 3.52 90 90 90 Ca 0.000 0.000 0.000 C 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	615
Below is a description of a superconductor material.	The chemical formula is Li2GaRh . The Tc_supercon is 1.24. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.22 4.22 4.22 60 60 60 Li 0.500 0.500 0.500 Li 0.250 0.250 0.250 Ga 0.750 0.750 0.750 Rh 0.000 0.000 0.000	616
Below is a description of a superconductor material.	The chemical formula is BaIrO3 . The Tc_supercon is 6.89. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.07 4.07 4.07 90 90 90 Ba 0.500 0.500 0.500 Ir 0.000 0.000 0.000 O 0.500 0.000 0.000 O 0.000 0.000 0.500 O 0.000 0.500 0.000	617
Below is a description of a superconductor material.	The chemical formula is CrB4 . The Tc_supercon is 0.01. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.86 4.74 5.47 90 90 90 Cr 0.000 0.000 0.000 Cr 0.500 0.500 0.500 B 0.000 0.165 0.366 B 0.000 0.835 0.634 B 0.500 0.335 0.866 B 0.500 0.665 0.134 B 0.000 0.223 0.679 B 0.000 0.777 0.321 B 0.500 0.277 0.179 B 0.500 0.723 0.821	618
Below is a description of a superconductor material.	The chemical formula is LiSc2Ga . The Tc_supercon is 0.02. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.74 4.74 4.74 60 60 60 Li 0.000 0.000 0.000 Sc 0.250 0.250 0.250 Sc 0.750 0.750 0.750 Ga 0.500 0.500 0.500	619
Below is a description of a superconductor material.	The chemical formula is TiIr3 . The Tc_supercon is 0.5. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.88 3.88 3.88 90 90 90 Ti 0.000 0.000 0.000 Ir 0.500 0.500 0.000 Ir 0.500 0.000 0.500 Ir 0.000 0.500 0.500	620
Below is a description of a superconductor material.	The chemical formula is Ti3Hg . The Tc_supercon is 3.09. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	5.17 5.17 5.17 90 90 90 Ti 0.500 0.250 0.000 Ti 0.500 0.750 0.000 Ti 0.250 0.000 0.500 Ti 0.750 0.000 0.500 Ti 0.000 0.500 0.250 Ti 0.000 0.500 0.750 Hg 0.500 0.500 0.500 Hg 0.000 0.000 0.000	621
Below is a description of a superconductor material.	The chemical formula is NaMgF . The Tc_supercon is 3.09. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	6.50 5.65 3.30 90 90 146 Na -0.263 -0.002 0.000 Mg 0.234 -0.053 0.000 F 0.254 0.302 0.000	622
Below is a description of a superconductor material.	The chemical formula is TiAlRu2 . The Tc_supercon is 0.16. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.31 4.31 4.31 60 60 60 Ti 0.750 0.750 0.750 Al 0.250 0.250 0.250 Ru 0.000 0.000 0.000 Ru 0.500 0.500 0.500	623
Below is a description of a superconductor material.	The chemical formula is NbOF2 . The Tc_supercon is 4.56. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.90 2.90 4.93 90 90 90 Nb 0.500 0.500 0.603 O 0.000 0.000 0.817 F 0.000 0.000 0.384 F 0.500 0.500 0.206	624
Below is a description of a superconductor material.	The chemical formula is SrMoO3 . The Tc_supercon is 0.41. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.99 3.99 3.99 90 90 90 Sr 0.500 0.500 0.500 Mo 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	625
Below is a description of a superconductor material.	The chemical formula is RbPdBr2 . The Tc_supercon is 1.88. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.93 3.93 7.70 90 90 90 Rb 0.500 0.500 0.589 Pd 0.000 0.000 0.026 Br 0.000 0.000 0.377 Br 0.500 0.500 0.017	626
Below is a description of a superconductor material.	The chemical formula is VN . The Tc_supercon is 2.65. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.76 2.76 5.30 90 90 120 V 0.000 0.000 0.500 V 0.000 0.000 0.000 N 0.333 0.667 0.250 N 0.667 0.333 0.750	627
Below is a description of a superconductor material.	The chemical formula is AsO . The Tc_supercon is 5.43. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.57 3.57 2.95 90 90 120 As 0.000 0.000 0.000 O 0.333 0.667 0.000	628
Below is a description of a superconductor material.	The chemical formula is LiB2 . The Tc_supercon is 16.43. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.33 3.33 2.69 90 90 120 Li 0.000 0.000 0.000 B 0.333 0.667 0.000 B 0.667 0.333 0.000	629
Below is a description of a superconductor material.	The chemical formula is NaGaF3 . The Tc_supercon is 0.97. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.16 4.16 4.16 90 90 90 Na 0.000 0.000 0.000 Ga 0.500 0.500 0.500 F 0.000 0.500 0.500 F 0.500 0.000 0.500 F 0.500 0.500 0.000	630
Below is a description of a superconductor material.	The chemical formula is LiBe2Ru . The Tc_supercon is 12.52. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.93 2.93 5.43 90 90 90 Li 0.500 0.500 0.000 Be 0.000 0.000 0.695 Be 0.000 0.000 0.305 Ru 0.500 0.500 0.500	631
Below is a description of a superconductor material.	The chemical formula is PRu . The Tc_supercon is 7.95. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.20 5.58 6.19 90 90 90 P 0.250 0.693 0.067 P 0.750 0.307 0.933 P 0.250 0.193 0.433 P 0.750 0.807 0.567 Ru 0.250 0.489 0.707 Ru 0.750 0.511 0.293 Ru 0.250 0.989 0.793 Ru 0.750 0.011 0.207	632
Below is a description of a superconductor material.	The chemical formula is TcB . The Tc_supercon is 2.46. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.89 2.89 2.93 90 90 120 Tc 0.000 0.000 0.000 B 0.667 0.333 0.500	633
Below is a description of a superconductor material.	The chemical formula is Co3Mo . The Tc_supercon is 0.78. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.58 3.58 3.58 90 90 90 Co 0.500 0.500 0.000 Co 0.500 0.000 0.500 Co 0.000 0.500 0.500 Mo 0.000 0.000 0.000	634
Below is a description of a superconductor material.	The chemical formula is B2Mo . The Tc_supercon is 13.79. 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	635
Below is a description of a superconductor material.	The chemical formula is NbCl3 . The Tc_supercon is 0.54. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.88 6.91 4.89 45 90 90 Nb 0.206 0.485 0.508 Cl 0.206 0.485 0.008 Cl 0.706 0.485 0.507 Cl 0.206 0.985 0.008	636
Below is a description of a superconductor material.	The chemical formula is TaBe2 . The Tc_supercon is 2.97. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.61 4.61 4.61 60 60 60 Ta 0.875 0.875 0.875 Ta 0.125 0.125 0.125 Be 0.500 0.500 0.500 Be 0.500 0.500 -0.000 Be -0.000 0.500 0.500 Be 0.500 0.000 0.500	637
Below is a description of a superconductor material.	The chemical formula is Sn . The Tc_supercon is 0.02. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.69 4.69 4.69 60 60 59 Sn 0.875 0.875 0.875 Sn 0.125 0.125 0.125	638
Below is a description of a superconductor material.	The chemical formula is Nb4C3 . The Tc_supercon is 11.51. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.48 4.48 4.48 90 90 90 Nb 0.000 0.500 0.000 Nb 0.000 0.000 0.500 Nb 0.500 0.000 0.000 Nb 0.500 0.500 0.500 C 0.500 0.000 0.500 C 0.500 0.500 0.000 C 0.000 0.500 0.500	639
Below is a description of a superconductor material.	The chemical formula is TiSnO2 . The Tc_supercon is 3.66. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.94 2.94 6.77 90 90 90 Ti 0.500 0.500 0.571 Sn 0.000 0.000 0.103 O 0.000 0.000 0.513 O 0.500 0.500 0.824	640
Below is a description of a superconductor material.	The chemical formula is NbCr2 . The Tc_supercon is 2.61. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.91 4.91 4.91 60 60 60 Nb 0.125 0.125 0.125 Nb 0.875 0.875 0.875 Cr 0.500 0.000 0.500 Cr -0.000 0.500 0.500 Cr 0.500 0.500 0.500 Cr 0.500 0.500 -0.000	641
Below is a description of a superconductor material.	The chemical formula is AlVOs2 . The Tc_supercon is 0.56. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.28 4.28 4.28 60 60 60 Al 0.250 0.250 0.250 V 0.750 0.750 0.750 Os 0.500 0.500 0.500 Os 1.000 0.000 -0.000	642
Below is a description of a superconductor material.	The chemical formula is BeZn2Co . The Tc_supercon is 0.04. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.75 2.75 6.17 90 90 90 Be 0.000 0.000 0.545 Zn 0.000 0.000 0.967 Zn 0.500 0.500 0.284 Co 0.500 0.500 0.704	643
Below is a description of a superconductor material.	The chemical formula is Be2CrFe . The Tc_supercon is 0.95. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.68 2.68 5.29 90 90 90 Be 0.000 0.000 0.010 Be 0.500 0.500 0.225 Cr 0.000 0.000 0.512 Fe 0.500 0.500 0.753	644
Below is a description of a superconductor material.	The chemical formula is LiSiNi2 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.93 3.93 3.93 60 60 60 Li 0.500 0.500 0.500 Si 0.000 0.000 0.000 Ni 0.250 0.250 0.250 Ni 0.750 0.750 0.750	645
Below is a description of a superconductor material.	The chemical formula is ZrC . The Tc_supercon is 0.58. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.34 3.34 3.34 60 59 59 Zr 0.000 0.000 0.000 C 0.500 0.500 0.500	646
Below is a description of a superconductor material.	The chemical formula is InP . The Tc_supercon is 10.48. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.93 3.93 3.93 60 60 60 In 0.000 0.000 0.000 P 0.500 0.500 0.500	647
Below is a description of a superconductor material.	The chemical formula is V3Pt . The Tc_supercon is 10.25. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.81 4.81 4.81 90 90 90 V 0.500 0.250 0.000 V 0.500 0.750 0.000 V 0.250 0.000 0.500 V 0.750 0.000 0.500 V 0.000 0.500 0.250 V 0.000 0.500 0.750 Pt 0.500 0.500 0.500 Pt 0.000 0.000 0.000	648
Below is a description of a superconductor material.	The chemical formula is TaBeO3 . The Tc_supercon is 5.8. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.42 3.42 3.42 90 90 90 Ta 0.000 0.000 0.000 Be 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	649
Below is a description of a superconductor material.	The chemical formula is Ti3In . The Tc_supercon is 7.69. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.15 4.15 4.15 90 90 90 Ti 0.000 0.500 0.500 Ti 0.500 0.000 0.500 Ti 0.500 0.500 0.000 In 0.000 0.000 0.000	650
Below is a description of a superconductor material.	The chemical formula is AlNiF2 . The Tc_supercon is 1.58. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.90 2.90 5.02 90 90 90 Al 0.500 0.500 0.461 Ni 0.000 0.000 0.124 F 0.000 0.000 0.598 F 0.500 0.500 0.828	651
Below is a description of a superconductor material.	The chemical formula is NaTeF2 . The Tc_supercon is 3.64. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.09 3.09 6.94 90 90 90 Na 0.500 0.500 0.562 Te 0.000 0.000 0.113 F 0.000 0.000 0.465 F 0.500 0.500 0.870	652
Below is a description of a superconductor material.	The chemical formula is AlNi6Ge . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.58 3.58 7.16 90 90 90 Al 0.000 0.000 0.000 Ni 0.500 0.500 0.000 Ni 0.500 0.500 0.500 Ni 0.500 0.000 0.250 Ni 0.500 0.000 0.750 Ni 0.000 0.500 0.250 Ni 0.000 0.500 0.750 Ge 0.000 0.000 0.500	653
Below is a description of a superconductor material.	The chemical formula is Zr3O . The Tc_supercon is 2.26. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	5.65 5.65 5.22 90 90 119 Zr 0.340 -0.000 0.500 Zr 0.660 0.000 0.000 Zr 0.340 0.340 0.000 Zr -0.000 0.340 0.500 Zr 0.660 0.660 0.500 Zr 0.000 0.660 0.000 O 0.667 0.333 0.250 O 0.333 0.667 0.750	654
Below is a description of a superconductor material.	The chemical formula is TaB2 . The Tc_supercon is 17.19. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.10 3.10 3.36 90 90 120 Ta 0.000 0.000 0.000 B 0.667 0.333 0.500 B 0.333 0.667 0.500	655
Below is a description of a superconductor material.	The chemical formula is Be2NiPt . The Tc_supercon is 0.48. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.80 2.80 5.38 90 90 90 Be 0.000 0.000 0.022 Be 0.500 0.500 0.249 Ni 0.000 0.000 0.440 Pt 0.500 0.500 0.789	656
Below is a description of a superconductor material.	The chemical formula is AlCo . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.85 2.85 2.85 90 90 90 Al 0.000 0.000 0.000 Co 0.500 0.500 0.500	657
Below is a description of a superconductor material.	The chemical formula is ZrScBe2 . The Tc_supercon is 2.46. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.14 3.14 6.40 90 90 90 Zr 0.500 0.500 0.500 Sc 0.500 0.500 0.000 Be 0.000 0.000 0.756 Be 0.000 0.000 0.244	658
Below is a description of a superconductor material.	The chemical formula is ZrBe5 . The Tc_supercon is 1.84. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.57 4.57 3.46 90 90 120 Zr 0.000 0.000 0.000 Be 0.333 0.667 0.000 Be 0.667 0.333 0.000 Be -0.000 0.500 0.500 Be 0.500 0.500 0.500 Be 0.500 -0.000 0.500	659
Below is a description of a superconductor material.	The chemical formula is BaInO3 . The Tc_supercon is 0.01. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.26 4.26 4.26 89 89 89 Ba -0.006 -0.006 -0.006 In 0.494 0.494 0.494 O 0.494 -0.006 0.494 O 0.494 0.494 -0.006 O -0.006 0.494 0.494	660
Below is a description of a superconductor material.	The chemical formula is YPd3 . 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 Y 0.000 0.000 0.000 Pd 0.500 0.500 0.000 Pd 0.500 0.000 0.500 Pd 0.000 0.500 0.500	661
Below is a description of a superconductor material.	The chemical formula is TiZnN2 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.94 2.94 4.87 90 90 90 Ti 0.500 0.500 0.557 Zn 0.000 0.000 0.043 N 0.000 0.000 0.475 N 0.500 0.500 0.936	662
Below is a description of a superconductor material.	The chemical formula is FeN . The Tc_supercon is 10.87. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.48 2.48 2.48 90 90 90 Fe 0.000 0.000 0.000 N 0.500 0.500 0.500	663
Below is a description of a superconductor material.	The chemical formula is TiO . The Tc_supercon is 0.04. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.85 2.85 5.55 89 89 119 Ti 0.667 0.333 0.003 Ti 0.333 0.667 0.503 O 1.000 1.000 0.753 O -0.000 -0.000 0.253	664
Below is a description of a superconductor material.	The chemical formula is ZnGeO3 . The Tc_supercon is 0.01. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.72 3.72 3.72 90 90 90 Zn 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	665
Below is a description of a superconductor material.	The chemical formula is Ta3Sn . The Tc_supercon is 5.32. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	5.31 5.31 5.31 90 90 90 Ta 0.250 0.000 0.500 Ta 0.750 0.000 0.500 Ta 0.000 0.500 0.250 Ta 0.000 0.500 0.750 Ta 0.500 0.750 0.000 Ta 0.500 0.250 0.000 Sn 0.000 0.000 0.000 Sn 0.500 0.500 0.500	666
Below is a description of a superconductor material.	The chemical formula is SbAsO . The Tc_supercon is 3.78. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.04 3.04 6.97 90 90 90 Sb 0.000 0.000 0.716 As 0.000 0.000 0.260 O 0.000 0.000 0.005	667
Below is a description of a superconductor material.	The chemical formula is CaMg . The Tc_supercon is 0.07. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.93 5.57 5.57 90 90 90 Ca 0.500 0.750 0.250 Ca 0.500 0.250 0.750 Mg 0.000 0.750 0.750 Mg 0.000 0.250 0.250	668
Below is a description of a superconductor material.	The chemical formula is MgCO3 . The Tc_supercon is 11.79. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.38 3.38 3.38 90 90 90 Mg 0.000 0.000 0.000 C 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	669
Below is a description of a superconductor material.	The chemical formula is NbMoO4 . The Tc_supercon is 16.97. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.97 4.97 2.85 90 90 89 Nb 0.500 0.500 0.500 Mo 0.000 0.000 0.000 O 0.209 0.209 0.500 O 0.791 0.791 0.500 O 0.718 0.282 0.000 O 0.282 0.718 0.000	670
Below is a description of a superconductor material.	The chemical formula is NbPO . The Tc_supercon is 7.4. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.72 2.72 6.35 90 90 90 Nb 0.000 0.000 0.025 P 0.000 0.000 0.585 O 0.000 0.000 0.334	671
Below is a description of a superconductor material.	The chemical formula is Nb3Al . The Tc_supercon is 8.96. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	5.22 5.22 5.22 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 Al 0.000 0.000 0.000 Al 0.500 0.500 0.500	672
Below is a description of a superconductor material.	The chemical formula is Mo3Ir . The Tc_supercon is 5.04. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	5.00 5.00 5.00 90 90 90 Mo 0.500 0.250 0.000 Mo 0.500 0.750 0.000 Mo 0.250 0.000 0.500 Mo 0.750 0.000 0.500 Mo 0.000 0.500 0.250 Mo 0.000 0.500 0.750 Ir 0.500 0.500 0.500 Ir 0.000 0.000 0.000	673
Below is a description of a superconductor material.	The chemical formula is PtRh3 . The Tc_supercon is 1.5. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.87 3.87 3.87 90 90 90 Pt 0.000 0.000 0.000 Rh 0.500 0.000 0.500 Rh 0.500 0.500 0.000 Rh 0.000 0.500 0.500	674
Below is a description of a superconductor material.	The chemical formula is VP . The Tc_supercon is 0.09. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.17 3.17 6.24 90 90 119 V 0.000 0.000 0.000 V 0.000 0.000 0.500 P 0.667 0.333 0.750 P 0.333 0.667 0.250	675
Below is a description of a superconductor material.	The chemical formula is BaSbO3 . The Tc_supercon is 15.05. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.26 4.26 4.26 90 90 90 Ba 0.000 0.000 0.000 Sb 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	676
Below is a description of a superconductor material.	The chemical formula is Al2FeIr . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.18 4.18 4.18 60 59 60 Al 0.500 0.500 0.500 Al -0.000 0.000 1.000 Fe 0.250 0.250 0.250 Ir 0.750 0.750 0.750	677
Below is a description of a superconductor material.	The chemical formula is VCoB3 . The Tc_supercon is 0.02. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.98 3.03 8.87 99 90 90 V 0.250 0.074 0.149 V 0.750 0.926 0.851 Co 0.250 0.796 0.592 Co 0.750 0.204 0.408 B 0.250 0.375 0.751 B 0.750 0.625 0.249 B 0.250 0.475 0.950 B 0.750 0.525 0.050 B 0.750 0.321 0.642 B 0.250 0.679 0.358	678
Below is a description of a superconductor material.	The chemical formula is MgGaO3 . The Tc_supercon is 0.02. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.81 3.81 3.81 90 90 90 Mg 0.000 0.000 0.000 Ga 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	679
Below is a description of a superconductor material.	The chemical formula is BMo . The Tc_supercon is 6.07. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.09 3.17 4.56 110 90 90 B 0.250 0.441 0.883 B 0.750 0.559 0.117 Mo 0.250 0.145 0.290 Mo 0.750 0.855 0.710	680
Below is a description of a superconductor material.	The chemical formula is ScRu3C . The Tc_supercon is 1.04. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.08 4.08 4.08 90 90 90 Sc 0.000 0.000 0.000 Ru 0.000 0.500 0.500 Ru 0.500 0.000 0.500 Ru 0.500 0.500 0.000 C 0.500 0.500 0.500	681
Below is a description of a superconductor material.	The chemical formula is Li2Si . The Tc_supercon is 0.23. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.34 4.34 6.63 70 70 60 Li 0.644 0.644 0.068 Li 0.356 0.356 0.932 Li 0.205 0.205 0.384 Li 0.795 0.795 0.616 Si 0.938 0.938 0.187 Si 0.062 0.062 0.813	682
Below is a description of a superconductor material.	The chemical formula is TiAlNi2 . The Tc_supercon is 1.87. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.17 4.17 4.17 59 60 59 Ti 0.500 0.500 0.500 Al 0.000 0.000 0.000 Ni 0.250 0.250 0.250 Ni 0.750 0.750 0.750	683
Below is a description of a superconductor material.	The chemical formula is Sc3AlC . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.50 4.50 4.50 90 90 90 Sc 0.000 0.500 0.500 Sc 0.500 0.500 0.000 Sc 0.500 0.000 0.500 Al 0.000 0.000 0.000 C 0.500 0.500 0.500	684
Below is a description of a superconductor material.	The chemical formula is HfRh3 . The Tc_supercon is 0.22. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.94 3.94 3.94 90 90 90 Hf 0.000 0.000 0.000 Rh 0.500 0.000 0.500 Rh 0.000 0.500 0.500 Rh 0.500 0.500 0.000	685
Below is a description of a superconductor material.	The chemical formula is Sc2CuRu . The Tc_supercon is 2.33. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.55 4.55 4.55 60 60 60 Sc 0.000 0.000 0.000 Sc 0.500 0.500 0.500 Cu 0.250 0.250 0.250 Ru 0.750 0.750 0.750	686
Below is a description of a superconductor material.	The chemical formula is RhOF . The Tc_supercon is 7.33. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.70 3.70 2.70 90 90 119 Rh 0.667 0.333 0.000 O 0.333 0.667 0.000 F 0.000 0.000 0.000	687
Below is a description of a superconductor material.	The chemical formula is Li3MnP2 . The Tc_supercon is 0.11. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.94 3.94 5.59 90 90 90 Li 0.000 0.000 0.000 Li 0.500 0.500 0.000 Li 0.500 0.500 0.500 Mn 0.000 0.000 0.500 P 0.000 0.500 0.287 P 0.500 0.000 0.713	688
Below is a description of a superconductor material.	The chemical formula is Sc2NiIr . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.52 4.52 4.52 60 60 60 Sc 0.000 0.000 0.000 Sc 0.500 0.500 0.500 Ni 0.750 0.750 0.750 Ir 0.250 0.250 0.250	689
Below is a description of a superconductor material.	The chemical formula is HfBe2Ni . The Tc_supercon is 8.54. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.82 2.82 6.07 90 90 90 Hf 0.000 0.000 0.502 Be 0.000 0.000 0.002 Be 0.500 0.500 0.187 Ni 0.500 0.500 0.809	690
Below is a description of a superconductor material.	The chemical formula is TiReTc2 . The Tc_supercon is 10.69. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.38 4.38 4.38 60 60 60 Ti 0.750 0.750 0.750 Re 0.250 0.250 0.250 Tc 0.500 0.500 0.500 Tc 0.000 0.000 0.000	691
Below is a description of a superconductor material.	The chemical formula is ScInCu2 . The Tc_supercon is 0.3. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	4.53 4.53 4.53 60 60 60 Sc 0.500 0.500 0.500 In 0.000 0.000 0.000 Cu 0.750 0.750 0.750 Cu 0.250 0.250 0.250	692
Below is a description of a superconductor material.	The chemical formula is CdNi3N . The Tc_supercon is 3.09. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.86 3.86 3.86 90 90 90 Cd 0.000 0.000 0.000 Ni 0.500 0.500 0.000 Ni 0.500 0.000 0.500 Ni 0.000 0.500 0.500 N 0.500 0.500 0.500	693
Below is a description of a superconductor material.	The chemical formula is Ba2SbTe . The Tc_supercon is 0.02. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	6.00 6.00 6.00 60 60 60 Ba 0.250 0.250 0.250 Ba 0.750 0.750 0.750 Sb 0.000 0.000 0.000 Te 0.500 0.500 0.500	694
Below is a description of a superconductor material.	The chemical formula is TiBe2V . The Tc_supercon is 6.14. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.00 3.00 5.19 90 90 90 Ti 0.500 0.500 0.000 Be 0.000 0.000 0.726 Be 0.000 0.000 0.274 V 0.500 0.500 0.500	695
Below is a description of a superconductor material.	The chemical formula is HfB . The Tc_supercon is 2.1. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.42 3.42 3.42 60 60 60 Hf 0.500 0.500 0.500 B 0.000 0.000 0.000	696
Below is a description of a superconductor material.	The chemical formula is Mn2BeFe . The Tc_supercon is 10.1. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	2.71 2.71 5.34 90 90 90 Mn 0.000 0.000 0.011 Mn 0.500 0.500 0.258 Be 0.000 0.000 0.504 Fe 0.500 0.500 0.727	697
Below is a description of a superconductor material.	The chemical formula is NaInF . The Tc_supercon is 4.06. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.52 7.05 3.25 90 90 60 Na 0.016 -0.132 0.000 In -0.040 0.424 0.000 F 0.331 0.057 0.000	698
Below is a description of a superconductor material.	The chemical formula is MgSc . The Tc_supercon is 0.36. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.	3.57 5.06 5.06 90 90 90 Mg 0.500 0.750 0.250 Mg 0.500 0.250 0.750 Sc 0.000 0.750 0.750 Sc 0.000 0.250 0.250	699

Below is a description of a superconductor material.

The chemical formula is MgBeBr . The Tc_supercon is 1.68. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

6.00 3.56 3.63 90 90 90 Mg -0.228 0.424 0.000 Be 0.062 -0.076 0.000 Br 0.415 -0.076 0.000

600

Below is a description of a superconductor material.

The chemical formula is MnN . The Tc_supercon is 20.59. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.62 2.67 5.20 90 90 89 Mn 0.499 0.876 0.060 Mn 0.499 0.376 0.639 N 0.499 0.876 0.404 N 0.999 0.376 0.927

601

Below is a description of a superconductor material.

The chemical formula is LiBN . The Tc_supercon is 14.28. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.18 3.18 3.18 60 60 60 Li 0.750 0.750 0.750 B 0.250 0.250 0.250 N 0.000 0.000 0.000

602

Below is a description of a superconductor material.

The chemical formula is Sc . The Tc_supercon is 1.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.29 3.29 5.10 90 90 120 Sc 0.333 0.667 0.250 Sc 0.667 0.333 0.750

603

Below is a description of a superconductor material.

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

3.04 3.04 5.47 90 90 90 Hf 0.000 0.000 0.230 Hf 0.500 0.500 0.770 O 0.000 0.000 0.648 O 0.500 0.500 0.352

604

Below is a description of a superconductor material.

The chemical formula is ScMo3O8 . The Tc_supercon is 2.64. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.84 5.74 5.74 119 89 90 Sc 0.265 0.676 0.325 Mo 0.747 0.148 0.852 Mo 0.743 0.691 0.837 Mo 0.743 0.163 0.309 O 0.530 0.008 0.508 O 0.952 0.332 0.668 O -0.005 0.832 0.665 O 0.976 0.836 0.164 O 0.530 0.493 0.992 O 0.461 -0.013 0.014 O 0.522 0.500 0.500 O 0.995 0.336 0.168

605

Below is a description of a superconductor material.

The chemical formula is Cr3GaN . The Tc_supercon is 10.86. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.82 3.82 3.82 90 90 90 Cr 0.500 0.000 0.500 Cr 0.000 0.500 0.500 Cr 0.500 0.500 0.000 Ga 0.000 0.000 0.000 N 0.500 0.500 0.500

606

Below is a description of a superconductor material.

The chemical formula is HfBeZn2 . The Tc_supercon is 3.31. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.91 2.91 6.99 90 90 90 Hf 0.500 0.500 0.724 Be 0.000 0.000 0.468 Zn 0.000 0.000 0.025 Zn 0.500 0.500 0.283

607

Below is a description of a superconductor material.

The chemical formula is TiAlO3 . The Tc_supercon is 0.88. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.86 3.86 3.86 90 90 90 Ti 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

608

Below is a description of a superconductor material.

The chemical formula is YAu . The Tc_supercon is 3.07. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.59 3.59 3.59 90 90 90 Y 0.500 0.500 0.500 Au 0.000 0.000 0.000

609

Below is a description of a superconductor material.

The chemical formula is AlCo2Si2 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.94 3.94 4.65 90 90 120 Al 0.000 0.000 0.000 Co 0.333 0.667 0.836 Co 0.667 0.333 0.164 Si 0.667 0.333 0.653 Si 0.333 0.667 0.347

610

Below is a description of a superconductor material.

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

3.21 3.21 5.70 90 90 120 Zr 0.000 0.000 0.500 Zr 0.000 0.000 0.000 N 0.333 0.667 0.250 N 0.667 0.333 0.750

611

Below is a description of a superconductor material.

The chemical formula is V3Ge . The Tc_supercon is 15.42. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.76 4.76 4.76 90 90 90 V 0.000 0.500 0.750 V 0.500 0.250 0.000 V 0.750 0.000 0.500 V 0.000 0.500 0.250 V 0.500 0.750 0.000 V 0.250 0.000 0.500 Ge 0.500 0.500 0.500 Ge 0.000 0.000 0.000

612

Below is a description of a superconductor material.

The chemical formula is MnRh . The Tc_supercon is 8.64. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.94 2.94 2.94 90 90 90 Mn 0.000 0.000 0.000 Rh 0.500 0.500 0.500

613

Below is a description of a superconductor material.

The chemical formula is VTe . The Tc_supercon is 11.34. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.32 3.32 3.32 90 90 90 V 0.500 0.500 0.500 Te 0.000 0.000 0.000

614

Below is a description of a superconductor material.

The chemical formula is CaCO3 . The Tc_supercon is 7.78. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.52 3.52 3.52 90 90 90 Ca 0.000 0.000 0.000 C 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

615

Below is a description of a superconductor material.

The chemical formula is Li2GaRh . The Tc_supercon is 1.24. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.22 4.22 4.22 60 60 60 Li 0.500 0.500 0.500 Li 0.250 0.250 0.250 Ga 0.750 0.750 0.750 Rh 0.000 0.000 0.000

616

Below is a description of a superconductor material.

The chemical formula is BaIrO3 . The Tc_supercon is 6.89. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.07 4.07 4.07 90 90 90 Ba 0.500 0.500 0.500 Ir 0.000 0.000 0.000 O 0.500 0.000 0.000 O 0.000 0.000 0.500 O 0.000 0.500 0.000

617

Below is a description of a superconductor material.

The chemical formula is CrB4 . The Tc_supercon is 0.01. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.86 4.74 5.47 90 90 90 Cr 0.000 0.000 0.000 Cr 0.500 0.500 0.500 B 0.000 0.165 0.366 B 0.000 0.835 0.634 B 0.500 0.335 0.866 B 0.500 0.665 0.134 B 0.000 0.223 0.679 B 0.000 0.777 0.321 B 0.500 0.277 0.179 B 0.500 0.723 0.821

618

Below is a description of a superconductor material.

The chemical formula is LiSc2Ga . The Tc_supercon is 0.02. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.74 4.74 4.74 60 60 60 Li 0.000 0.000 0.000 Sc 0.250 0.250 0.250 Sc 0.750 0.750 0.750 Ga 0.500 0.500 0.500

619

Below is a description of a superconductor material.

The chemical formula is TiIr3 . The Tc_supercon is 0.5. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.88 3.88 3.88 90 90 90 Ti 0.000 0.000 0.000 Ir 0.500 0.500 0.000 Ir 0.500 0.000 0.500 Ir 0.000 0.500 0.500

620

Below is a description of a superconductor material.

The chemical formula is Ti3Hg . The Tc_supercon is 3.09. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

5.17 5.17 5.17 90 90 90 Ti 0.500 0.250 0.000 Ti 0.500 0.750 0.000 Ti 0.250 0.000 0.500 Ti 0.750 0.000 0.500 Ti 0.000 0.500 0.250 Ti 0.000 0.500 0.750 Hg 0.500 0.500 0.500 Hg 0.000 0.000 0.000

621

Below is a description of a superconductor material.

The chemical formula is NaMgF . The Tc_supercon is 3.09. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

6.50 5.65 3.30 90 90 146 Na -0.263 -0.002 0.000 Mg 0.234 -0.053 0.000 F 0.254 0.302 0.000

622

Below is a description of a superconductor material.

The chemical formula is TiAlRu2 . The Tc_supercon is 0.16. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.31 4.31 4.31 60 60 60 Ti 0.750 0.750 0.750 Al 0.250 0.250 0.250 Ru 0.000 0.000 0.000 Ru 0.500 0.500 0.500

623

Below is a description of a superconductor material.

The chemical formula is NbOF2 . The Tc_supercon is 4.56. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.90 2.90 4.93 90 90 90 Nb 0.500 0.500 0.603 O 0.000 0.000 0.817 F 0.000 0.000 0.384 F 0.500 0.500 0.206

624

Below is a description of a superconductor material.

The chemical formula is SrMoO3 . The Tc_supercon is 0.41. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.99 3.99 3.99 90 90 90 Sr 0.500 0.500 0.500 Mo 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

625

Below is a description of a superconductor material.

The chemical formula is RbPdBr2 . The Tc_supercon is 1.88. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.93 3.93 7.70 90 90 90 Rb 0.500 0.500 0.589 Pd 0.000 0.000 0.026 Br 0.000 0.000 0.377 Br 0.500 0.500 0.017

626

Below is a description of a superconductor material.

The chemical formula is VN . The Tc_supercon is 2.65. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.76 2.76 5.30 90 90 120 V 0.000 0.000 0.500 V 0.000 0.000 0.000 N 0.333 0.667 0.250 N 0.667 0.333 0.750

627

Below is a description of a superconductor material.

The chemical formula is AsO . The Tc_supercon is 5.43. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.57 3.57 2.95 90 90 120 As 0.000 0.000 0.000 O 0.333 0.667 0.000

628

Below is a description of a superconductor material.

The chemical formula is LiB2 . The Tc_supercon is 16.43. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.33 3.33 2.69 90 90 120 Li 0.000 0.000 0.000 B 0.333 0.667 0.000 B 0.667 0.333 0.000

629

Below is a description of a superconductor material.

The chemical formula is NaGaF3 . The Tc_supercon is 0.97. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.16 4.16 4.16 90 90 90 Na 0.000 0.000 0.000 Ga 0.500 0.500 0.500 F 0.000 0.500 0.500 F 0.500 0.000 0.500 F 0.500 0.500 0.000

630

Below is a description of a superconductor material.

The chemical formula is LiBe2Ru . The Tc_supercon is 12.52. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.93 2.93 5.43 90 90 90 Li 0.500 0.500 0.000 Be 0.000 0.000 0.695 Be 0.000 0.000 0.305 Ru 0.500 0.500 0.500

631

Below is a description of a superconductor material.

The chemical formula is PRu . The Tc_supercon is 7.95. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.20 5.58 6.19 90 90 90 P 0.250 0.693 0.067 P 0.750 0.307 0.933 P 0.250 0.193 0.433 P 0.750 0.807 0.567 Ru 0.250 0.489 0.707 Ru 0.750 0.511 0.293 Ru 0.250 0.989 0.793 Ru 0.750 0.011 0.207

632

Below is a description of a superconductor material.

The chemical formula is TcB . The Tc_supercon is 2.46. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.89 2.89 2.93 90 90 120 Tc 0.000 0.000 0.000 B 0.667 0.333 0.500

633

Below is a description of a superconductor material.

The chemical formula is Co3Mo . The Tc_supercon is 0.78. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.58 3.58 3.58 90 90 90 Co 0.500 0.500 0.000 Co 0.500 0.000 0.500 Co 0.000 0.500 0.500 Mo 0.000 0.000 0.000

634

Below is a description of a superconductor material.

The chemical formula is B2Mo . The Tc_supercon is 13.79. 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

635

Below is a description of a superconductor material.

The chemical formula is NbCl3 . The Tc_supercon is 0.54. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.88 6.91 4.89 45 90 90 Nb 0.206 0.485 0.508 Cl 0.206 0.485 0.008 Cl 0.706 0.485 0.507 Cl 0.206 0.985 0.008

636

Below is a description of a superconductor material.

The chemical formula is TaBe2 . The Tc_supercon is 2.97. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.61 4.61 4.61 60 60 60 Ta 0.875 0.875 0.875 Ta 0.125 0.125 0.125 Be 0.500 0.500 0.500 Be 0.500 0.500 -0.000 Be -0.000 0.500 0.500 Be 0.500 0.000 0.500

637

Below is a description of a superconductor material.

The chemical formula is Sn . The Tc_supercon is 0.02. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.69 4.69 4.69 60 60 59 Sn 0.875 0.875 0.875 Sn 0.125 0.125 0.125

638

Below is a description of a superconductor material.

The chemical formula is Nb4C3 . The Tc_supercon is 11.51. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.48 4.48 4.48 90 90 90 Nb 0.000 0.500 0.000 Nb 0.000 0.000 0.500 Nb 0.500 0.000 0.000 Nb 0.500 0.500 0.500 C 0.500 0.000 0.500 C 0.500 0.500 0.000 C 0.000 0.500 0.500

639

Below is a description of a superconductor material.

The chemical formula is TiSnO2 . The Tc_supercon is 3.66. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.94 2.94 6.77 90 90 90 Ti 0.500 0.500 0.571 Sn 0.000 0.000 0.103 O 0.000 0.000 0.513 O 0.500 0.500 0.824

640

Below is a description of a superconductor material.

The chemical formula is NbCr2 . The Tc_supercon is 2.61. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.91 4.91 4.91 60 60 60 Nb 0.125 0.125 0.125 Nb 0.875 0.875 0.875 Cr 0.500 0.000 0.500 Cr -0.000 0.500 0.500 Cr 0.500 0.500 0.500 Cr 0.500 0.500 -0.000

641

Below is a description of a superconductor material.

The chemical formula is AlVOs2 . The Tc_supercon is 0.56. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.28 4.28 4.28 60 60 60 Al 0.250 0.250 0.250 V 0.750 0.750 0.750 Os 0.500 0.500 0.500 Os 1.000 0.000 -0.000

642

Below is a description of a superconductor material.

The chemical formula is BeZn2Co . The Tc_supercon is 0.04. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.75 2.75 6.17 90 90 90 Be 0.000 0.000 0.545 Zn 0.000 0.000 0.967 Zn 0.500 0.500 0.284 Co 0.500 0.500 0.704

643

Below is a description of a superconductor material.

The chemical formula is Be2CrFe . The Tc_supercon is 0.95. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.68 2.68 5.29 90 90 90 Be 0.000 0.000 0.010 Be 0.500 0.500 0.225 Cr 0.000 0.000 0.512 Fe 0.500 0.500 0.753

644

Below is a description of a superconductor material.

The chemical formula is LiSiNi2 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.93 3.93 3.93 60 60 60 Li 0.500 0.500 0.500 Si 0.000 0.000 0.000 Ni 0.250 0.250 0.250 Ni 0.750 0.750 0.750

645

Below is a description of a superconductor material.

The chemical formula is ZrC . The Tc_supercon is 0.58. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.34 3.34 3.34 60 59 59 Zr 0.000 0.000 0.000 C 0.500 0.500 0.500

646

Below is a description of a superconductor material.

The chemical formula is InP . The Tc_supercon is 10.48. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.93 3.93 3.93 60 60 60 In 0.000 0.000 0.000 P 0.500 0.500 0.500

647

Below is a description of a superconductor material.

The chemical formula is V3Pt . The Tc_supercon is 10.25. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.81 4.81 4.81 90 90 90 V 0.500 0.250 0.000 V 0.500 0.750 0.000 V 0.250 0.000 0.500 V 0.750 0.000 0.500 V 0.000 0.500 0.250 V 0.000 0.500 0.750 Pt 0.500 0.500 0.500 Pt 0.000 0.000 0.000

648

Below is a description of a superconductor material.

The chemical formula is TaBeO3 . The Tc_supercon is 5.8. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.42 3.42 3.42 90 90 90 Ta 0.000 0.000 0.000 Be 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

649

Below is a description of a superconductor material.

The chemical formula is Ti3In . The Tc_supercon is 7.69. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.15 4.15 4.15 90 90 90 Ti 0.000 0.500 0.500 Ti 0.500 0.000 0.500 Ti 0.500 0.500 0.000 In 0.000 0.000 0.000

650

Below is a description of a superconductor material.

The chemical formula is AlNiF2 . The Tc_supercon is 1.58. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.90 2.90 5.02 90 90 90 Al 0.500 0.500 0.461 Ni 0.000 0.000 0.124 F 0.000 0.000 0.598 F 0.500 0.500 0.828

651

Below is a description of a superconductor material.

The chemical formula is NaTeF2 . The Tc_supercon is 3.64. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.09 3.09 6.94 90 90 90 Na 0.500 0.500 0.562 Te 0.000 0.000 0.113 F 0.000 0.000 0.465 F 0.500 0.500 0.870

652

Below is a description of a superconductor material.

The chemical formula is AlNi6Ge . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.58 3.58 7.16 90 90 90 Al 0.000 0.000 0.000 Ni 0.500 0.500 0.000 Ni 0.500 0.500 0.500 Ni 0.500 0.000 0.250 Ni 0.500 0.000 0.750 Ni 0.000 0.500 0.250 Ni 0.000 0.500 0.750 Ge 0.000 0.000 0.500

653

Below is a description of a superconductor material.

The chemical formula is Zr3O . The Tc_supercon is 2.26. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

5.65 5.65 5.22 90 90 119 Zr 0.340 -0.000 0.500 Zr 0.660 0.000 0.000 Zr 0.340 0.340 0.000 Zr -0.000 0.340 0.500 Zr 0.660 0.660 0.500 Zr 0.000 0.660 0.000 O 0.667 0.333 0.250 O 0.333 0.667 0.750

654

Below is a description of a superconductor material.

The chemical formula is TaB2 . The Tc_supercon is 17.19. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.10 3.10 3.36 90 90 120 Ta 0.000 0.000 0.000 B 0.667 0.333 0.500 B 0.333 0.667 0.500

655

Below is a description of a superconductor material.

The chemical formula is Be2NiPt . The Tc_supercon is 0.48. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.80 2.80 5.38 90 90 90 Be 0.000 0.000 0.022 Be 0.500 0.500 0.249 Ni 0.000 0.000 0.440 Pt 0.500 0.500 0.789

656

Below is a description of a superconductor material.

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

2.85 2.85 2.85 90 90 90 Al 0.000 0.000 0.000 Co 0.500 0.500 0.500

657

Below is a description of a superconductor material.

The chemical formula is ZrScBe2 . The Tc_supercon is 2.46. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.14 3.14 6.40 90 90 90 Zr 0.500 0.500 0.500 Sc 0.500 0.500 0.000 Be 0.000 0.000 0.756 Be 0.000 0.000 0.244

658

Below is a description of a superconductor material.

The chemical formula is ZrBe5 . The Tc_supercon is 1.84. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.57 4.57 3.46 90 90 120 Zr 0.000 0.000 0.000 Be 0.333 0.667 0.000 Be 0.667 0.333 0.000 Be -0.000 0.500 0.500 Be 0.500 0.500 0.500 Be 0.500 -0.000 0.500

659

Below is a description of a superconductor material.

The chemical formula is BaInO3 . The Tc_supercon is 0.01. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.26 4.26 4.26 89 89 89 Ba -0.006 -0.006 -0.006 In 0.494 0.494 0.494 O 0.494 -0.006 0.494 O 0.494 0.494 -0.006 O -0.006 0.494 0.494

660

Below is a description of a superconductor material.

The chemical formula is YPd3 . 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 Y 0.000 0.000 0.000 Pd 0.500 0.500 0.000 Pd 0.500 0.000 0.500 Pd 0.000 0.500 0.500

661

Below is a description of a superconductor material.

The chemical formula is TiZnN2 . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.94 2.94 4.87 90 90 90 Ti 0.500 0.500 0.557 Zn 0.000 0.000 0.043 N 0.000 0.000 0.475 N 0.500 0.500 0.936

662

Below is a description of a superconductor material.

The chemical formula is FeN . The Tc_supercon is 10.87. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.48 2.48 2.48 90 90 90 Fe 0.000 0.000 0.000 N 0.500 0.500 0.500

663

Below is a description of a superconductor material.

The chemical formula is TiO . The Tc_supercon is 0.04. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.85 2.85 5.55 89 89 119 Ti 0.667 0.333 0.003 Ti 0.333 0.667 0.503 O 1.000 1.000 0.753 O -0.000 -0.000 0.253

664

Below is a description of a superconductor material.

The chemical formula is ZnGeO3 . The Tc_supercon is 0.01. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.72 3.72 3.72 90 90 90 Zn 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

665

Below is a description of a superconductor material.

The chemical formula is Ta3Sn . The Tc_supercon is 5.32. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

5.31 5.31 5.31 90 90 90 Ta 0.250 0.000 0.500 Ta 0.750 0.000 0.500 Ta 0.000 0.500 0.250 Ta 0.000 0.500 0.750 Ta 0.500 0.750 0.000 Ta 0.500 0.250 0.000 Sn 0.000 0.000 0.000 Sn 0.500 0.500 0.500

666

Below is a description of a superconductor material.

The chemical formula is SbAsO . The Tc_supercon is 3.78. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.04 3.04 6.97 90 90 90 Sb 0.000 0.000 0.716 As 0.000 0.000 0.260 O 0.000 0.000 0.005

667

Below is a description of a superconductor material.

The chemical formula is CaMg . The Tc_supercon is 0.07. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.93 5.57 5.57 90 90 90 Ca 0.500 0.750 0.250 Ca 0.500 0.250 0.750 Mg 0.000 0.750 0.750 Mg 0.000 0.250 0.250

668

Below is a description of a superconductor material.

The chemical formula is MgCO3 . The Tc_supercon is 11.79. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.38 3.38 3.38 90 90 90 Mg 0.000 0.000 0.000 C 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

669

Below is a description of a superconductor material.

The chemical formula is NbMoO4 . The Tc_supercon is 16.97. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.97 4.97 2.85 90 90 89 Nb 0.500 0.500 0.500 Mo 0.000 0.000 0.000 O 0.209 0.209 0.500 O 0.791 0.791 0.500 O 0.718 0.282 0.000 O 0.282 0.718 0.000

670

Below is a description of a superconductor material.

The chemical formula is NbPO . The Tc_supercon is 7.4. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.72 2.72 6.35 90 90 90 Nb 0.000 0.000 0.025 P 0.000 0.000 0.585 O 0.000 0.000 0.334

671

Below is a description of a superconductor material.

The chemical formula is Nb3Al . The Tc_supercon is 8.96. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

5.22 5.22 5.22 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 Al 0.000 0.000 0.000 Al 0.500 0.500 0.500

672

Below is a description of a superconductor material.

The chemical formula is Mo3Ir . The Tc_supercon is 5.04. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

5.00 5.00 5.00 90 90 90 Mo 0.500 0.250 0.000 Mo 0.500 0.750 0.000 Mo 0.250 0.000 0.500 Mo 0.750 0.000 0.500 Mo 0.000 0.500 0.250 Mo 0.000 0.500 0.750 Ir 0.500 0.500 0.500 Ir 0.000 0.000 0.000

673

Below is a description of a superconductor material.

The chemical formula is PtRh3 . The Tc_supercon is 1.5. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.87 3.87 3.87 90 90 90 Pt 0.000 0.000 0.000 Rh 0.500 0.000 0.500 Rh 0.500 0.500 0.000 Rh 0.000 0.500 0.500

674

Below is a description of a superconductor material.

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

3.17 3.17 6.24 90 90 119 V 0.000 0.000 0.000 V 0.000 0.000 0.500 P 0.667 0.333 0.750 P 0.333 0.667 0.250

675

Below is a description of a superconductor material.

The chemical formula is BaSbO3 . The Tc_supercon is 15.05. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.26 4.26 4.26 90 90 90 Ba 0.000 0.000 0.000 Sb 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

676

Below is a description of a superconductor material.

The chemical formula is Al2FeIr . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.18 4.18 4.18 60 59 60 Al 0.500 0.500 0.500 Al -0.000 0.000 1.000 Fe 0.250 0.250 0.250 Ir 0.750 0.750 0.750

677

Below is a description of a superconductor material.

The chemical formula is VCoB3 . The Tc_supercon is 0.02. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.98 3.03 8.87 99 90 90 V 0.250 0.074 0.149 V 0.750 0.926 0.851 Co 0.250 0.796 0.592 Co 0.750 0.204 0.408 B 0.250 0.375 0.751 B 0.750 0.625 0.249 B 0.250 0.475 0.950 B 0.750 0.525 0.050 B 0.750 0.321 0.642 B 0.250 0.679 0.358

678

Below is a description of a superconductor material.

The chemical formula is MgGaO3 . The Tc_supercon is 0.02. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.81 3.81 3.81 90 90 90 Mg 0.000 0.000 0.000 Ga 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

679

Below is a description of a superconductor material.

The chemical formula is BMo . The Tc_supercon is 6.07. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.09 3.17 4.56 110 90 90 B 0.250 0.441 0.883 B 0.750 0.559 0.117 Mo 0.250 0.145 0.290 Mo 0.750 0.855 0.710

680

Below is a description of a superconductor material.

The chemical formula is ScRu3C . The Tc_supercon is 1.04. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.08 4.08 4.08 90 90 90 Sc 0.000 0.000 0.000 Ru 0.000 0.500 0.500 Ru 0.500 0.000 0.500 Ru 0.500 0.500 0.000 C 0.500 0.500 0.500

681

Below is a description of a superconductor material.

The chemical formula is Li2Si . The Tc_supercon is 0.23. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.34 4.34 6.63 70 70 60 Li 0.644 0.644 0.068 Li 0.356 0.356 0.932 Li 0.205 0.205 0.384 Li 0.795 0.795 0.616 Si 0.938 0.938 0.187 Si 0.062 0.062 0.813

682

Below is a description of a superconductor material.

The chemical formula is TiAlNi2 . The Tc_supercon is 1.87. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.17 4.17 4.17 59 60 59 Ti 0.500 0.500 0.500 Al 0.000 0.000 0.000 Ni 0.250 0.250 0.250 Ni 0.750 0.750 0.750

683

Below is a description of a superconductor material.

The chemical formula is Sc3AlC . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.50 4.50 4.50 90 90 90 Sc 0.000 0.500 0.500 Sc 0.500 0.500 0.000 Sc 0.500 0.000 0.500 Al 0.000 0.000 0.000 C 0.500 0.500 0.500

684

Below is a description of a superconductor material.

The chemical formula is HfRh3 . The Tc_supercon is 0.22. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.94 3.94 3.94 90 90 90 Hf 0.000 0.000 0.000 Rh 0.500 0.000 0.500 Rh 0.000 0.500 0.500 Rh 0.500 0.500 0.000

685

Below is a description of a superconductor material.

The chemical formula is Sc2CuRu . The Tc_supercon is 2.33. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.55 4.55 4.55 60 60 60 Sc 0.000 0.000 0.000 Sc 0.500 0.500 0.500 Cu 0.250 0.250 0.250 Ru 0.750 0.750 0.750

686

Below is a description of a superconductor material.

The chemical formula is RhOF . The Tc_supercon is 7.33. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.70 3.70 2.70 90 90 119 Rh 0.667 0.333 0.000 O 0.333 0.667 0.000 F 0.000 0.000 0.000

687

Below is a description of a superconductor material.

The chemical formula is Li3MnP2 . The Tc_supercon is 0.11. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.94 3.94 5.59 90 90 90 Li 0.000 0.000 0.000 Li 0.500 0.500 0.000 Li 0.500 0.500 0.500 Mn 0.000 0.000 0.500 P 0.000 0.500 0.287 P 0.500 0.000 0.713

688

Below is a description of a superconductor material.

The chemical formula is Sc2NiIr . The Tc_supercon is 0.0. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.52 4.52 4.52 60 60 60 Sc 0.000 0.000 0.000 Sc 0.500 0.500 0.500 Ni 0.750 0.750 0.750 Ir 0.250 0.250 0.250

689

Below is a description of a superconductor material.

The chemical formula is HfBe2Ni . The Tc_supercon is 8.54. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.82 2.82 6.07 90 90 90 Hf 0.000 0.000 0.502 Be 0.000 0.000 0.002 Be 0.500 0.500 0.187 Ni 0.500 0.500 0.809

690

Below is a description of a superconductor material.

The chemical formula is TiReTc2 . The Tc_supercon is 10.69. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.38 4.38 4.38 60 60 60 Ti 0.750 0.750 0.750 Re 0.250 0.250 0.250 Tc 0.500 0.500 0.500 Tc 0.000 0.000 0.000

691

Below is a description of a superconductor material.

The chemical formula is ScInCu2 . The Tc_supercon is 0.3. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

4.53 4.53 4.53 60 60 60 Sc 0.500 0.500 0.500 In 0.000 0.000 0.000 Cu 0.750 0.750 0.750 Cu 0.250 0.250 0.250

692

Below is a description of a superconductor material.

The chemical formula is CdNi3N . The Tc_supercon is 3.09. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.86 3.86 3.86 90 90 90 Cd 0.000 0.000 0.000 Ni 0.500 0.500 0.000 Ni 0.500 0.000 0.500 Ni 0.000 0.500 0.500 N 0.500 0.500 0.500

693

Below is a description of a superconductor material.

The chemical formula is Ba2SbTe . The Tc_supercon is 0.02. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

6.00 6.00 6.00 60 60 60 Ba 0.250 0.250 0.250 Ba 0.750 0.750 0.750 Sb 0.000 0.000 0.000 Te 0.500 0.500 0.500

694

Below is a description of a superconductor material.

The chemical formula is TiBe2V . The Tc_supercon is 6.14. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.00 3.00 5.19 90 90 90 Ti 0.500 0.500 0.000 Be 0.000 0.000 0.726 Be 0.000 0.000 0.274 V 0.500 0.500 0.500

695

Below is a description of a superconductor material.

The chemical formula is HfB . The Tc_supercon is 2.1. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.42 3.42 3.42 60 60 60 Hf 0.500 0.500 0.500 B 0.000 0.000 0.000

696

Below is a description of a superconductor material.

The chemical formula is Mn2BeFe . The Tc_supercon is 10.1. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

2.71 2.71 5.34 90 90 90 Mn 0.000 0.000 0.011 Mn 0.500 0.500 0.258 Be 0.000 0.000 0.504 Fe 0.500 0.500 0.727

697

Below is a description of a superconductor material.

The chemical formula is NaInF . The Tc_supercon is 4.06. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.52 7.05 3.25 90 90 60 Na 0.016 -0.132 0.000 In -0.040 0.424 0.000 F 0.331 0.057 0.000

698

Below is a description of a superconductor material.

The chemical formula is MgSc . The Tc_supercon is 0.36. Generate atomic structure description with lattice lengths, angles, coordinates and atom types.

3.57 5.06 5.06 90 90 90 Mg 0.500 0.750 0.250 Mg 0.500 0.250 0.750 Sc 0.000 0.750 0.750 Sc 0.000 0.250 0.250

699