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M3XH8-NbAl3H8
dict
M3XH8-ScAl3H8
dict
M3XH8-Ca3FeH8
dict
M3XH8-LiCa3H8
dict
M3XH8-Ca3MnH8
dict
M3XH8-NaCa3H8
dict
M3XH8-Ca3NbH8
dict
M3XH8-Ca3H8W
dict
M3XH8-Ca3YH8
dict
M3XH8-LiMg3H8
dict
M3XH8-Mg3H8Os
dict
M3XH8-Mg3ReH8
dict
M3XH8-Mg3H8Ru
dict
M3XH8-Mg3TcH8
dict
M3XH8-Mg3TiH8
dict
M3XH8-Sr3H8Os
dict
M3XH8-Sr3H8Ru
dict
M3XH8-Sr3TcH8
dict
MXH3-GaFeH3
dict
MXH3-InNiH3
dict
MXH3-InH3Pd
dict
MXH3-KHgH3
dict
MXH3-KScH3
dict
MXH3-RbCdH3
dict
MXH3-SrH3Au
dict
MXH3-SrScH3
dict
MXH3-SrTcH3
dict
MXH3-SrZnH3
dict
X2YH6-Li2CuH6
dict
X2YH6-Mg2H6Pt
dict
X2YH6-Mg2H6Pd
dict
X2YH6-Mg2H6Ir
dict
X2YH6-Mg2H6Rh
dict
X2YH6-Na2AgH6
dict
X2YH6-Mn(AlH3)2
dict
X2YH6-Al2TcH6
dict
X2YH6-Al2ReH6
dict
X2YH6-Ca2AgH6
dict
X2YH6-Li(CaH3)2
dict
X2YH6-Na2H6Au
dict
X2YH6-Na2CuH6
dict
X2YH6-Ga2H6Ru
dict
X2YH6-Mg2NiH6
dict
X2YH6-Ga2H6Os
dict
MXH3-KInH3
dict
MXH3-AlHgH3
dict
MXH3-HgH3Pb
dict
MXH3-H3OsPb
dict
X2YMH6-K2InCuH6
dict
X2YMH6-K2LiCuH6
dict
X2YMH6-Na2LiCuH6
dict
X2YMH6-Na2SiH6Pd
dict
X2YMH6-Na2LiZnH6
dict
X2YMH6-Na2GaH6Ru
dict
X2YMH6-Cs2NaSnH6
dict
X2YMH6-K2AlHgH6
dict
X2YMH6-K2HgH6Au
dict
X2YMH6-K2InAgH6
dict
X2YMH6-Rb2AlHgH6
dict
X2YMH6-Na2CdCuH6
dict
X2YMH6-Na2MgCuH6
dict
X2YMH6-CuH6RuPb2
dict
X2YMH6-K2AlCdH6
dict
MXH3-NaH3Pd
dict
XYMH6-KBeH6Pt
dict
XYMH6-RbBeH6Pt
dict
XYMH6-CsBeH6Pt
dict
X2YMH6-Li2GaCuH6
dict
X2YMH6-K2CdAgH6
dict
X2YMH6-Na2H6IrPd
dict
X2YH6-Ca2CuH6
dict
X2YH6-K2CuH6
dict
X2YMH6-K2CdCuH6
dict
X2YMH6-K2GaCuH6
dict
X2YMH6-K2LiZnH6
dict
X2YH6-Li2H6Au
dict
X2YMH6-Na2GaCuH6
dict
X2YMH6-Na2LiAgH6
dict
LaH10-CaB8C
dict
LaH10-SrB8C
dict
LaH10-BaB8C
dict
LaH10-Na(BN)5
dict
LaH10-Al(BN)5
dict
LaH10-In(BN)5
dict
LaH10-La(BN)5
dict
LaH10-Y(BN)5
dict
LaH10-KB6PbC6
dict
LaH10-RbBa(BC)6
dict
LaH10-Li(BN)4
dict
LaH10-Mg(BN)4
dict
MgB2-MgB2
dict
LowTc-VTc
dict
LowTc-YGa2
dict
LowTc-TaCr2
dict
LowTc-Sc2Al
dict
LowTc-V3Pt
dict
LowTc-ClF2
dict
LowTc-Co2N
dict
LowTc-BeCrO2
dict
LowTc-Sc2AlCu
dict
LowTc-Ti2ZnTc
dict
LowTc-V2N3
dict
LowTc-VI
dict
LowTc-Mn
dict
LowTc-ScTaBe2
dict
LowTc-ZrSc
dict
LowTc-Sr(BP)2
dict
LowTc-Nb3Si
dict
LowTc-TiO
dict
LowTc-Sc2MnSi
dict
LowTc-TiC
dict
LowTc-MnBe2Tc
dict
LowTc-Sc2ZnTc
dict
LowTc-Sc
dict
LowTc-MgTaO2
dict
LowTc-HfTaRu2
dict
LowTc-TiFeAs
dict
LowTc-ZrScBe2
dict
LowTc-Sc2GaAg
dict
LowTc-NiAs
dict
LowTc-TiAsPd
dict
LowTc-AlOs
dict
LowTc-Cr3As
dict
LowTc-Re3W
dict
LowTc-TiOF
dict
LowTc-ZrN
dict
LowTc-HfCo2
dict
LowTc-VRu
dict
LowTc-LiCa2Ga
dict
LowTc-Be2ZnPd
dict
LowTc-LiAl
dict
LowTc-NbC
dict
LowTc-NaScF2
dict
LowTc-ScBe2Rh
dict
LowTc-CrSi
dict
LowTc-HfBeZn2
dict
LowTc-BeV2Ge
dict
LowTc-TaTiOs2
dict
LowTc-CrH
dict
LowTc-HfTc
dict
{ "cif": "# generated using pymatgen\ndata_NbAl3H8\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.49440000\n_cell_length_b 4.49440000\n_cell_length_c 4.49440000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_ScAl3H8\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.55650000\n_cell_length_b 4.55650000\n_cell_length_c 4.55650000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Ca3FeH8\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.71060000\n_cell_length_b 4.71060000\n_cell_length_c 4.71060000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_LiCa3H8\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.19630000\n_cell_length_b 5.19630000\n_cell_length_c 5.19630000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Ca3MnH8\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.74860000\n_cell_length_b 4.74860000\n_cell_length_c 4.74860000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_NaCa3H8\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.11630000\n_cell_length_b 5.11630000\n_cell_length_c 5.11630000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Ca3NbH8\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.99690000\n_cell_length_b 4.99690000\n_cell_length_c 4.99690000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Ca3H8W\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.98860000\n_cell_length_b 4.98860000\n_cell_length_c 4.98860000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_Ca3YH8\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.29080000\n_cell_length_b 5.29080000\n_cell_length_c 5.29080000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_LiMg3H8\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.65080000\n_cell_length_b 4.65080000\n_cell_length_c 4.65080000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Mg3H8Os\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.54350000\n_cell_length_b 4.54350000\n_cell_length_c 4.54350000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Mg3ReH8\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.55040000\n_cell_length_b 4.55040000\n_cell_length_c 4.55040000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Mg3H8Ru\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.54980000\n_cell_length_b 4.54980000\n_cell_length_c 4.54980000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Mg3TcH8\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.54350000\n_cell_length_b 4.54350000\n_cell_length_c 4.54350000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Mg3TiH8\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.60580000\n_cell_length_b 4.60580000\n_cell_length_c 4.60580000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Sr3H8Os\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.05040000\n_cell_length_b 5.05040000\n_cell_length_c 5.05040000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Sr3H8Ru\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.07770000\n_cell_length_b 5.07770000\n_cell_length_c 5.07770000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Sr3TcH8\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.13900000\n_cell_length_b 5.13900000\n_cell_length_c 5.13900000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_GaFeH3\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.31200000\n_cell_length_b 3.31200000\n_cell_length_c 3.31200000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_InNiH3\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.47200000\n_cell_length_b 3.47200000\n_cell_length_c 3.47200000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_InH3Pd\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.56700000\n_cell_length_b 3.56700000\n_cell_length_c 3.56700000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_KHgH3\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.82800000\n_cell_length_b 3.82800000\n_cell_length_c 3.82800000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical_...
{ "cif": "# generated using pymatgen\ndata_KScH3\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.98000000\n_cell_length_b 3.98000000\n_cell_length_c 3.98000000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical_...
{ "cif": "# generated using pymatgen\ndata_RbCdH3\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.87700000\n_cell_length_b 3.87700000\n_cell_length_c 3.87700000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_SrH3Au\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.71300000\n_cell_length_b 3.71300000\n_cell_length_c 3.71300000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_SrScH3\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.99800000\n_cell_length_b 3.99800000\n_cell_length_c 3.99800000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_SrTcH3\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.76600000\n_cell_length_b 3.76600000\n_cell_length_c 3.76600000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_SrZnH3\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.71400000\n_cell_length_b 3.71400000\n_cell_length_c 3.71400000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_Li2CuH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.46680000\n_cell_length_b 4.46680000\n_cell_length_c 4.46680000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Mg2H6Pt\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.67870000\n_cell_length_b 4.67870000\n_cell_length_c 4.67870000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Mg2H6Pd\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.65450000\n_cell_length_b 4.65450000\n_cell_length_c 4.65450000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Mg2H6Ir\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.67990000\n_cell_length_b 4.67990000\n_cell_length_c 4.67990000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Mg2H6Rh\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.64700000\n_cell_length_b 4.64700000\n_cell_length_c 4.64700000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Na2AgH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.15087800\n_cell_length_b 5.15087800\n_cell_length_c 5.15087800\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Mn(AlH3)2\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.31450000\n_cell_length_b 4.31450000\n_cell_length_c 4.31450000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemi...
{ "cif": "# generated using pymatgen\ndata_Al2TcH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.48600000\n_cell_length_b 4.48600000\n_cell_length_c 4.48600000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Al2ReH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.51310000\n_cell_length_b 4.51310000\n_cell_length_c 4.51310000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Ca2AgH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.11620000\n_cell_length_b 5.11620000\n_cell_length_c 5.11620000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Li(CaH3)2\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.94650000\n_cell_length_b 4.94650000\n_cell_length_c 4.94650000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemi...
{ "cif": "# generated using pymatgen\ndata_Na2H6Au\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.09110000\n_cell_length_b 5.09110000\n_cell_length_c 5.09110000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Na2CuH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.61399600\n_cell_length_b 4.61399600\n_cell_length_c 4.61399600\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Ga2H6Ru\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.65320000\n_cell_length_b 4.65320000\n_cell_length_c 4.65320000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Mg2NiH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.50850000\n_cell_length_b 4.50850000\n_cell_length_c 4.50850000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Ga2H6Os\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.67400000\n_cell_length_b 4.67400000\n_cell_length_c 4.67400000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_KInH3\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.22630000\n_cell_length_b 4.22630000\n_cell_length_c 4.22630000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical_...
{ "cif": "# generated using pymatgen\ndata_AlHgH3\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.79620000\n_cell_length_b 3.79620000\n_cell_length_c 3.79620000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_HgH3Pb\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.24700000\n_cell_length_b 4.24700000\n_cell_length_c 4.24700000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_H3OsPb\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.74420000\n_cell_length_b 3.74420000\n_cell_length_c 3.74420000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_K2InCuH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.58260000\n_cell_length_b 5.58260000\n_cell_length_c 5.58260000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemic...
{ "cif": "# generated using pymatgen\ndata_K2LiCuH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.20101500\n_cell_length_b 5.20101500\n_cell_length_c 5.20101500\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemic...
{ "cif": "# generated using pymatgen\ndata_Na2LiCuH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.80289200\n_cell_length_b 4.80289229\n_cell_length_c 4.80289229\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 59.99999800\n_cell_angle_gamma 59.99999800\n_symmetry_Int_Tables_number 1\n_chemi...
{ "cif": "# generated using pymatgen\ndata_Na2SiH6Pd\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.13170000\n_cell_length_b 5.13170000\n_cell_length_c 5.13170000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemi...
{ "cif": "# generated using pymatgen\ndata_Na2LiZnH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.12230000\n_cell_length_b 5.12230000\n_cell_length_c 5.12230000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemi...
{ "cif": "# generated using pymatgen\ndata_Na2GaH6Ru\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.11050000\n_cell_length_b 5.11050000\n_cell_length_c 5.11050000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemi...
{ "cif": "# generated using pymatgen\ndata_Cs2NaSnH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 6.38380000\n_cell_length_b 6.38380000\n_cell_length_c 6.38380000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemi...
{ "cif": "# generated using pymatgen\ndata_K2AlHgH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.75140000\n_cell_length_b 5.75140000\n_cell_length_c 5.75140000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemic...
{ "cif": "# generated using pymatgen\ndata_K2HgH6Au\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.79720000\n_cell_length_b 5.79720000\n_cell_length_c 5.79720000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemic...
{ "cif": "# generated using pymatgen\ndata_K2InAgH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.73430000\n_cell_length_b 5.73430000\n_cell_length_c 5.73430000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemic...
{ "cif": "# generated using pymatgen\ndata_Rb2AlHgH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.89300000\n_cell_length_b 5.89300000\n_cell_length_c 5.89300000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemi...
{ "cif": "# generated using pymatgen\ndata_Na2CdCuH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.27920000\n_cell_length_b 5.27920000\n_cell_length_c 5.27920000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemi...
{ "cif": "# generated using pymatgen\ndata_Na2MgCuH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.22970000\n_cell_length_b 5.22970000\n_cell_length_c 5.22970000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemi...
{ "cif": "# generated using pymatgen\ndata_CuH6RuPb2\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.24604229\n_cell_length_b 5.24604229\n_cell_length_c 5.38500000\n_cell_angle_alpha 119.15000000\n_cell_angle_beta 119.15011760\n_cell_angle_gamma 89.99989457\n_symmetry_Int_Tables_number 1\n_che...
{ "cif": "# generated using pymatgen\ndata_K2AlCdH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.73830000\n_cell_length_b 5.73830000\n_cell_length_c 5.73830000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemic...
{ "cif": "# generated using pymatgen\ndata_NaH3Pd\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 6.65920000\n_cell_length_b 6.65920000\n_cell_length_c 6.65920000\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_KBeH6Pt\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.43880000\n_cell_length_b 4.43880000\n_cell_length_c 5.61150000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 120.00000000\n_symmetry_Int_Tables_number 1\n_chemic...
{ "cif": "# generated using pymatgen\ndata_RbBeH6Pt\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.44360000\n_cell_length_b 4.44360000\n_cell_length_c 6.00880000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 120.00000000\n_symmetry_Int_Tables_number 1\n_chemi...
{ "cif": "# generated using pymatgen\ndata_CsBeH6Pt\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.44460000\n_cell_length_b 4.44460000\n_cell_length_c 6.43280000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 120.00000000\n_symmetry_Int_Tables_number 1\n_chemi...
{ "cif": "# generated using pymatgen\ndata_Li2GaCuH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.77354341\n_cell_length_b 4.77354341\n_cell_length_c 5.06650000\n_cell_angle_alpha 61.89500000\n_cell_angle_beta 61.89500000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemi...
{ "cif": "# generated using pymatgen\ndata_K2CdAgH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.59873583\n_cell_length_b 5.59873583\n_cell_length_c 5.80710000\n_cell_angle_alpha 118.82000000\n_cell_angle_beta 118.82146085\n_cell_angle_gamma 89.99867247\n_symmetry_Int_Tables_number 1\n_chem...
{ "cif": "# generated using pymatgen\ndata_Na2H6IrPd\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.01130000\n_cell_length_b 5.01130000\n_cell_length_c 5.30130000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 120.00000000\n_symmetry_Int_Tables_number 1\n_chem...
{ "cif": "# generated using pymatgen\ndata_Ca2CuH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.77225500\n_cell_length_b 4.77225471\n_cell_length_c 4.77225471\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000200\n_cell_angle_gamma 60.00000200\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_K2CuH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.19271300\n_cell_length_b 5.19271331\n_cell_length_c 5.19271331\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 59.99999800\n_cell_angle_gamma 59.99999800\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_K2CdCuH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.27991700\n_cell_length_b 5.27991700\n_cell_length_c 5.27991700\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemic...
{ "cif": "# generated using pymatgen\ndata_K2GaCuH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.20269400\n_cell_length_b 5.20269431\n_cell_length_c 5.20269431\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 59.99999800\n_cell_angle_gamma 59.99999800\n_symmetry_Int_Tables_number 1\n_chemic...
{ "cif": "# generated using pymatgen\ndata_K2LiZnH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.54070000\n_cell_length_b 5.54069967\n_cell_length_c 5.54069967\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000200\n_cell_angle_gamma 60.00000200\n_symmetry_Int_Tables_number 1\n_chemic...
{ "cif": "# generated using pymatgen\ndata_Li2H6Au\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.71655100\n_cell_length_b 4.71655100\n_cell_length_c 4.71655100\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Na2GaCuH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.95338600\n_cell_length_b 4.95338600\n_cell_length_c 4.95338600\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemi...
{ "cif": "# generated using pymatgen\ndata_Na2LiAgH6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.26033500\n_cell_length_b 5.26033468\n_cell_length_c 5.26033468\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000200\n_cell_angle_gamma 60.00000200\n_symmetry_Int_Tables_number 1\n_chemi...
{ "cif": "# generated using pymatgen\ndata_CaB8C\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.67900000\n_cell_length_b 4.67900000\n_cell_length_c 7.75960000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 120.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_SrB8C\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.67900000\n_cell_length_b 4.67900000\n_cell_length_c 7.75960000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 120.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_BaB8C\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.67900000\n_cell_length_b 4.67900000\n_cell_length_c 7.75960000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 120.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_Na(BN)5\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.91439213\n_cell_length_b 4.91439213\n_cell_length_c 4.91439213\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Al(BN)5\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.91439213\n_cell_length_b 4.91439213\n_cell_length_c 4.91439213\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_In(BN)5\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.91439213\n_cell_length_b 4.91439213\n_cell_length_c 4.91439213\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_La(BN)5\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.91439213\n_cell_length_b 4.91439213\n_cell_length_c 4.91439213\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Y(BN)5\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.91439213\n_cell_length_b 4.91439213\n_cell_length_c 4.91439213\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_KB6PbC6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.90200000\n_cell_length_b 4.90200000\n_cell_length_c 4.90200000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_RbBa(BC)6\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.90200000\n_cell_length_b 4.90200000\n_cell_length_c 4.90200000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemi...
{ "cif": "# generated using pymatgen\ndata_Li(BN)4\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.78970000\n_cell_length_b 3.78970000\n_cell_length_c 3.78970000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Mg(BN)4\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.78970000\n_cell_length_b 3.78970000\n_cell_length_c 3.78970000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_MgB2\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.07368000\n_cell_length_b 3.07368003\n_cell_length_c 3.53435000\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 119.99999966\n_symmetry_Int_Tables_number 1\n_chemical_...
{ "cif": "# generated using pymatgen\ndata_VTc\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 2.98719291\n_cell_length_b 2.98719291\n_cell_length_c 2.98719291\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical_fo...
{ "cif": "# generated using pymatgen\ndata_YGa2\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.02844520\n_cell_length_b 4.16699487\n_cell_length_c 4.16699487\n_cell_angle_alpha 120.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical_...
{ "cif": "# generated using pymatgen\ndata_TaCr2\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.84809409\n_cell_length_b 4.84809409\n_cell_length_c 4.84809409\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemical_...
{ "cif": "# generated using pymatgen\ndata_Sc2Al\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.84598139\n_cell_length_b 4.84598139\n_cell_length_c 6.09202424\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 120.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_V3Pt\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.75278115\n_cell_length_b 4.75278115\n_cell_length_c 4.75278115\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical_f...
{ "cif": "# generated using pymatgen\ndata_ClF2\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 2.66121491\n_cell_length_b 3.91528945\n_cell_length_c 4.61092387\n_cell_angle_alpha 94.98900311\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical_f...
{ "cif": "# generated using pymatgen\ndata_Co2N\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 2.78950935\n_cell_length_b 4.22256410\n_cell_length_c 4.48498766\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical_f...
{ "cif": "# generated using pymatgen\ndata_BeCrO2\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 2.47426485\n_cell_length_b 2.47426485\n_cell_length_c 5.01453738\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_Sc2AlCu\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.66896650\n_cell_length_b 4.66896650\n_cell_length_c 4.66896650\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Ti2ZnTc\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.36334820\n_cell_length_b 4.36334820\n_cell_length_c 4.36334820\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_V2N3\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 2.78003440\n_cell_length_b 2.78003440\n_cell_length_c 6.19837150\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 120.00000000\n_symmetry_Int_Tables_number 1\n_chemical_...
{ "cif": "# generated using pymatgen\ndata_VI\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.29185814\n_cell_length_b 3.29185814\n_cell_length_c 3.29185814\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical_for...
{ "cif": "# generated using pymatgen\ndata_Mn\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 2.44682560\n_cell_length_b 2.44682560\n_cell_length_c 2.44682560\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemical_for...
{ "cif": "# generated using pymatgen\ndata_ScTaBe2\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 2.92742736\n_cell_length_b 4.33990156\n_cell_length_c 4.33990156\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_ZrSc\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.22192594\n_cell_length_b 3.22192594\n_cell_length_c 5.08100712\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 120.00000000\n_symmetry_Int_Tables_number 1\n_chemical_...
{ "cif": "# generated using pymatgen\ndata_Sr(BP)2\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.61478143\n_cell_length_b 3.61478143\n_cell_length_c 6.31889414\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 120.00000000\n_symmetry_Int_Tables_number 1\n_chemic...
{ "cif": "# generated using pymatgen\ndata_Nb3Si\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.05952447\n_cell_length_b 5.05952447\n_cell_length_c 5.05952447\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical_...
{ "cif": "# generated using pymatgen\ndata_TiO\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.03643457\n_cell_length_b 4.03643457\n_cell_length_c 4.03643457\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical_fo...
{ "cif": "# generated using pymatgen\ndata_Sc2MnSi\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.46762291\n_cell_length_b 4.46762291\n_cell_length_c 4.46762291\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_TiC\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.03606688\n_cell_length_b 3.03606688\n_cell_length_c 3.03606688\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemical_fo...
{ "cif": "# generated using pymatgen\ndata_MnBe2Tc\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.86532758\n_cell_length_b 3.86532758\n_cell_length_c 3.86532758\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Sc2ZnTc\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.57473490\n_cell_length_b 4.57473490\n_cell_length_c 4.57473490\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Sc\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.27647025\n_cell_length_b 3.27647025\n_cell_length_c 5.08470735\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 120.00000000\n_symmetry_Int_Tables_number 1\n_chemical_fo...
{ "cif": "# generated using pymatgen\ndata_MgTaO2\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 2.93094142\n_cell_length_b 2.93094142\n_cell_length_c 5.36075202\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_HfTaRu2\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.48914831\n_cell_length_b 4.48914831\n_cell_length_c 4.48914831\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_TiFeAs\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.67587200\n_cell_length_b 6.09481779\n_cell_length_c 6.09481779\n_cell_angle_alpha 120.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_ZrScBe2\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.11356321\n_cell_length_b 3.11356321\n_cell_length_c 6.35157900\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Sc2GaAg\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.74611233\n_cell_length_b 4.74611233\n_cell_length_c 4.74611233\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_NiAs\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.60793600\n_cell_length_b 3.60793600\n_cell_length_c 4.95917487\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 120.00000000\n_symmetry_Int_Tables_number 1\n_chemical_...
{ "cif": "# generated using pymatgen\ndata_TiAsPd\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.77176462\n_cell_length_b 6.51586433\n_cell_length_c 6.51586433\n_cell_angle_alpha 120.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_AlOs\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 2.99270108\n_cell_length_b 2.99270108\n_cell_length_c 2.99270108\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical_f...
{ "cif": "# generated using pymatgen\ndata_Cr3As\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.52492984\n_cell_length_b 4.52492984\n_cell_length_c 4.52492984\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical_...
{ "cif": "# generated using pymatgen\ndata_Re3W\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.50515556\n_cell_length_b 5.52628641\n_cell_length_c 5.52628641\n_cell_angle_alpha 120.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical_...
{ "cif": "# generated using pymatgen\ndata_TiOF\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 2.84696687\n_cell_length_b 2.84696687\n_cell_length_c 3.91470323\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical_f...
{ "cif": "# generated using pymatgen\ndata_ZrN\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.21867795\n_cell_length_b 3.21867795\n_cell_length_c 3.21867795\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemical_fo...
{ "cif": "# generated using pymatgen\ndata_HfCo2\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.79590897\n_cell_length_b 4.79590897\n_cell_length_c 4.79590897\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemical_...
{ "cif": "# generated using pymatgen\ndata_VRu\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 2.96960711\n_cell_length_b 2.96960711\n_cell_length_c 2.96960711\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical_fo...
{ "cif": "# generated using pymatgen\ndata_LiCa2Ga\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 5.23021915\n_cell_length_b 5.23021915\n_cell_length_c 5.23021915\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_Be2ZnPd\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 2.86027334\n_cell_length_b 2.86027334\n_cell_length_c 5.40212850\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_LiAl\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.46307265\n_cell_length_b 4.46307265\n_cell_length_c 4.46307265\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemical_f...
{ "cif": "# generated using pymatgen\ndata_NbC\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.14571279\n_cell_length_b 3.14571279\n_cell_length_c 3.14571279\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemical_fo...
{ "cif": "# generated using pymatgen\ndata_NaScF2\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.08119472\n_cell_length_b 3.08119472\n_cell_length_c 6.28310393\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_ScBe2Rh\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 2.89701506\n_cell_length_b 2.89701506\n_cell_length_c 6.03152389\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_CrSi\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.54845660\n_cell_length_b 4.54845660\n_cell_length_c 4.54845660\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical_f...
{ "cif": "# generated using pymatgen\ndata_HfBeZn2\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 2.89796710\n_cell_length_b 2.89796710\n_cell_length_c 6.81053402\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_BeV2Ge\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.10999111\n_cell_length_b 3.10999111\n_cell_length_c 5.17897850\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical...
{ "cif": "# generated using pymatgen\ndata_TaTiOs2\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 4.40012754\n_cell_length_b 4.40012754\n_cell_length_c 4.40012754\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemica...
{ "cif": "# generated using pymatgen\ndata_CrH\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 2.64347725\n_cell_length_b 2.64347725\n_cell_length_c 2.64347725\n_cell_angle_alpha 60.00000000\n_cell_angle_beta 60.00000000\n_cell_angle_gamma 60.00000000\n_symmetry_Int_Tables_number 1\n_chemical_fo...
{ "cif": "# generated using pymatgen\ndata_HfTc\n_symmetry_space_group_name_H-M 'P 1'\n_cell_length_a 3.23630430\n_cell_length_b 3.23630430\n_cell_length_c 3.23630430\n_cell_angle_alpha 90.00000000\n_cell_angle_beta 90.00000000\n_cell_angle_gamma 90.00000000\n_symmetry_Int_Tables_number 1\n_chemical_f...

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Check out the documentation for more information.

HTSC-2025

We present HTSC-2025, an open-source benchmark of ambient-pressure high-Tc superconductors predicted from 2023–2025, designed to standardize AI evaluation and accelerate physics-informed superconductor discovery.

Crystalline materials included in the HTSC-2025 benchmark

Material Class Avg Tc (K) Max Tc Formula Space Group Max Tc (K) Count
X2YH6 55.4 Mg2IrH6 Fm-3m 160 19
LaH10 53.0 KPbB6C6 Pm-3 88 12
X2YMH6 35.5 Na2LiAgH6 Fm-3m 86 23
MXH3 35.3 SrAuH3 Pm-3m 132 15
M3XH8 20.4 Mg3OsH8 Pm-3m 73 18
Others 7.9 MgB2 P63/mmc 39.0 53
Total 27.3 Mg2IrH6 Fm-3m 160 140

Citation

If you use the HTSC-2025 dataset in your research, please cite our work:

@misc{han2025htsc2025benchmarkdatasetambientpressure,
  title={HTSC-2025: A Benchmark Dataset of Ambient-Pressure High-Temperature Superconductors for AI-Driven Critical Temperature Prediction}, 
  author={Xiao-Qi Han and Ze-Feng Gao and Xin-De Wang and Zhenfeng Ouyang and Peng-Jie Guo and Zhong-Yi Lu},
  year={2025},
  eprint={2506.03837},
  archivePrefix={arXiv},
  primaryClass={cond-mat.supr-con},
  url={https://arxiv.org/abs/2506.03837}, 
}
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