HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=970",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=968",
"results": [
{
"id": "jvasp-87043",
"created_at": "2022-09-04T14:38:17.534175Z",
"updated_at": "2022-09-04T14:38:17.534205Z",
"structure_string": "Sm2 Cu2 P4\n1.0\n3.727630 -0.000000 -0.722505\n-0.140039 3.724999 -0.722505\n0.058494 0.060734 10.279050\nSm Cu P\n2 2 4\ndirect\n0.883906 0.883907 0.767814 Sm\n0.116092 0.116092 0.232185 Sm\n0.749999 0.250000 0.499999 Cu\n0.249999 0.750000 0.499999 Cu\n0.674629 0.674630 0.349259 P\n0.325369 0.325369 0.650740 P\n0.500000 0.000000 -0.000000 P\n-0.000000 0.500000 -0.000000 P\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Sm",
"Cu",
"P"
],
"chemical_system": "Cu-P-Sm",
"density": 6.404001201292226,
"density_atomic": 0.055922137394508534,
"volume": 143.05604851193667,
"volume_molar": 10.76879575885339,
"formula_full": "Sm2 Cu2 P4",
"formula_reduced": "SmCuP2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.5396850812500005,
"spacegroup": 139
},
{
"id": "jvasp-65106",
"created_at": "2022-09-04T14:38:17.526598Z",
"updated_at": "2022-09-04T14:38:17.526608Z",
"structure_string": "Be1 Zn1 Si4\n1.0\n0.000000 3.594892 3.594892\n3.594892 -0.000000 3.594892\n3.594892 3.594892 -0.000000\nBe Zn Si\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Zn\n0.124016 0.625328 0.625328 Si\n0.625328 0.625328 0.625328 Si\n0.625328 0.124016 0.625328 Si\n0.625328 0.625328 0.124016 Si\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Zn",
"Si"
],
"chemical_system": "Be-Si-Zn",
"density": 3.3377424620193903,
"density_atomic": 0.06457489549687359,
"volume": 92.91536523338998,
"volume_molar": 9.325823470038078,
"formula_full": "Be1 Zn1 Si4",
"formula_reduced": "BeZnSi4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.4915668166666665,
"spacegroup": 216
},
{
"id": "jvasp-109258",
"created_at": "2022-09-04T14:38:17.510809Z",
"updated_at": "2022-09-04T14:38:17.510835Z",
"structure_string": "Rb3 Ir1 F6\n1.0\n5.634476 -0.000000 3.253066\n1.878159 5.312235 3.253066\n-0.000000 -0.000000 6.506132\nRb Ir F\n3 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750001 0.749999 0.750001 Rb\n0.500001 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Ir\n0.220665 0.220665 0.779335 F\n0.220666 0.779334 0.779335 F\n0.779336 0.779334 0.220666 F\n0.220666 0.779334 0.220666 F\n0.779336 0.220665 0.779335 F\n0.779336 0.220665 0.220665 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Ir",
"F"
],
"chemical_system": "F-Ir-Rb",
"density": 4.797373087953582,
"density_atomic": 0.051350694010749404,
"volume": 194.7393349329742,
"volume_molar": 11.727476864751557,
"formula_full": "Rb3 Ir1 F6",
"formula_reduced": "Rb3IrF6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-110036",
"created_at": "2022-09-04T14:38:17.510224Z",
"updated_at": "2022-09-04T14:38:17.510252Z",
"structure_string": "Sr3 Ag1\n1.0\n5.366740 -0.000000 0.000000\n0.000000 5.366740 0.000000\n-0.000000 -0.000000 5.366740\nSr Ag\n3 1\ndirect\n-0.000000 0.500000 0.500000 Sr\n0.500000 0.000000 0.500000 Sr\n0.500000 0.500000 -0.000000 Sr\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sr",
"Ag"
],
"chemical_system": "Ag-Sr",
"density": 3.9826583547122905,
"density_atomic": 0.02587785792325032,
"volume": 154.57229929399003,
"volume_molar": 23.271403598631416,
"formula_full": "Sr3 Ag1",
"formula_reduced": "Sr3Ag",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-9574",
"created_at": "2022-09-04T14:38:17.510191Z",
"updated_at": "2022-09-04T14:38:17.510220Z",
"structure_string": "Ga3 As3 O12\n1.0\n2.496352 -4.323808 -0.000000\n2.496352 4.323808 0.000000\n0.000000 -0.000000 11.569669\nGa As O\n3 3 12\ndirect\n0.446763 -0.000000 0.333333 Ga\n-0.000000 0.446763 0.666667 Ga\n0.553236 0.553236 0.000000 Ga\n0.444159 -0.000000 0.833333 As\n-0.000000 0.444159 0.166667 As\n0.555840 0.555840 0.500000 As\n0.068883 0.676143 0.285655 O\n0.931116 0.607259 0.047679 O\n0.676143 0.068883 0.714345 O\n0.392740 0.323856 0.381012 O\n0.390309 0.302499 0.870033 O\n0.087809 0.697500 0.796635 O\n0.912191 0.609691 0.536700 O\n0.607259 0.931116 0.952321 O\n0.609691 0.912191 0.463300 O\n0.302499 0.390309 0.129967 O\n0.697500 0.087809 0.203366 O\n0.323856 0.392740 0.618988 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Ga",
"As",
"O"
],
"chemical_system": "As-Ga-O",
"density": 4.161494755020015,
"density_atomic": 0.07206914189572243,
"volume": 249.76015429799872,
"volume_molar": 8.356060030121485,
"formula_full": "Ga3 As3 O12",
"formula_reduced": "GaAsO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.874899679166667,
"spacegroup": 152
},
{
"id": "jvasp-17178",
"created_at": "2022-09-04T14:38:17.508448Z",
"updated_at": "2022-09-04T14:38:17.508462Z",
"structure_string": "La1 N1\n1.0\n3.173697 -0.000000 -0.000000\n0.000000 3.173697 0.000000\n0.000000 0.000000 3.173697\nLa N\n1 1\ndirect\n0.000000 0.000000 0.000000 La\n0.500001 0.500001 0.500001 N\n",
"nsites": 2,
"nelements": 2,
"elements": [
"La",
"N"
],
"chemical_system": "La-N",
"density": 7.943186598850931,
"density_atomic": 0.06256531157429354,
"volume": 31.966595381293487,
"volume_molar": 9.625366850205763,
"formula_full": "La1 N1",
"formula_reduced": "LaN",
"formula_anonymous": "AB",
"energy_above_hull": 1.865339125,
"spacegroup": 221
},
{
"id": "jvasp-49241",
"created_at": "2022-09-04T14:38:17.501994Z",
"updated_at": "2022-09-04T14:38:17.502021Z",
"structure_string": "K4 Ca1 U3 O12\n1.0\n7.054475 0.000000 -2.494133\n-3.527237 6.109355 -2.494133\n-0.000000 -0.000000 7.482400\nK Ca U O\n4 1 3 12\ndirect\n0.499999 0.500000 0.500000 K\n0.500000 -0.000000 0.000000 K\n-0.000000 0.500000 -0.000000 K\n0.000000 0.000000 0.500000 K\n0.000000 0.000000 0.000000 Ca\n-0.000000 0.500000 0.500000 U\n0.499999 0.500000 0.000000 U\n0.500000 0.000000 0.500000 U\n0.728176 0.728177 0.000000 O\n0.728177 0.000000 0.728177 O\n0.499999 0.250000 0.750000 O\n0.271822 0.271822 0.000000 O\n-0.000001 0.728177 0.728177 O\n0.499999 0.749999 0.250000 O\n0.749999 0.500000 0.250000 O\n0.249999 0.500000 0.750000 O\n0.749999 0.250000 0.500000 O\n0.249999 0.749999 0.500000 O\n-0.000000 0.271822 0.271823 O\n0.271822 0.000000 0.271823 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"K",
"Ca",
"U",
"O"
],
"chemical_system": "Ca-K-O-U",
"density": 5.677363441355593,
"density_atomic": 0.06201960757186507,
"volume": 322.4786609109877,
"volume_molar": 9.71005944051139,
"formula_full": "K4 Ca1 U3 O12",
"formula_reduced": "K4CaU3O12",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 2.545121121,
"spacegroup": 229
},
{
"id": "jvasp-109063",
"created_at": "2022-09-04T14:38:17.496416Z",
"updated_at": "2022-09-04T14:38:17.496438Z",
"structure_string": "Nd2 Mg1\n1.0\n3.734732 0.195954 -6.239937\n-0.118347 3.737996 -6.239937\n-0.180136 -0.195954 7.269979\nNd Mg\n2 1\ndirect\n0.658626 0.658627 -0.000001 Nd\n0.341372 0.341373 -0.000001 Nd\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Nd",
"Mg"
],
"chemical_system": "Mg-Nd",
"density": 5.586862745660407,
"density_atomic": 0.032269236328125984,
"volume": 92.96780281674,
"volume_molar": 18.662173157011093,
"formula_full": "Nd2 Mg1",
"formula_reduced": "Nd2Mg",
"formula_anonymous": "AB2",
"energy_above_hull": 0.8076308333333335,
"spacegroup": 139
},
{
"id": "jvasp-107888",
"created_at": "2022-09-04T14:38:17.494237Z",
"updated_at": "2022-09-04T14:38:17.494269Z",
"structure_string": "Ac3 Tm1\n1.0\n4.981501 0.010141 -4.416941\n-1.001327 4.879836 -4.416941\n-0.008254 -0.010141 6.657676\nAc Tm\n3 1\ndirect\n0.750000 0.250000 0.500001 Ac\n0.250000 0.750001 0.500001 Ac\n0.500000 0.500000 0.000000 Ac\n0.000000 0.000000 0.000000 Tm\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ac",
"Tm"
],
"chemical_system": "Ac-Tm",
"density": 8.741009907100626,
"density_atomic": 0.024773490203815005,
"volume": 161.4629172995583,
"volume_molar": 24.308810387454482,
"formula_full": "Ac3 Tm1",
"formula_reduced": "Ac3Tm",
"formula_anonymous": "AB3",
"energy_above_hull": 0.9043460625,
"spacegroup": 139
},
{
"id": "jvasp-109089",
"created_at": "2022-09-04T14:38:17.485418Z",
"updated_at": "2022-09-04T14:38:17.485437Z",
"structure_string": "Y1 Tm1 Ru2\n1.0\n4.128485 0.000000 2.383582\n1.376162 3.892373 2.383582\n0.000000 -0.000000 4.767164\nY Tm Ru\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.500001 0.500000 0.499999 Tm\n0.250000 0.250000 0.250000 Ru\n0.750001 0.749999 0.749999 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Tm",
"Ru"
],
"chemical_system": "Ru-Tm-Y",
"density": 9.970635683107517,
"density_atomic": 0.05221493433528605,
"volume": 76.60643551354352,
"volume_molar": 11.533368444610549,
"formula_full": "Y1 Tm1 Ru2",
"formula_reduced": "YTmRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.203145175,
"spacegroup": 225
},
{
"id": "jvasp-20488",
"created_at": "2022-09-04T14:38:17.480853Z",
"updated_at": "2022-09-04T14:38:17.480876Z",
"structure_string": "Tb1 Tl3\n1.0\n4.751193 0.000000 0.000000\n0.000000 4.751193 0.000000\n0.000000 0.000000 4.751193\nTb Tl\n1 3\ndirect\n0.000000 0.000000 0.000000 Tb\n0.000000 0.500000 0.500000 Tl\n0.500000 0.500000 0.000000 Tl\n0.500000 0.000000 0.500000 Tl\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Tb",
"Tl"
],
"chemical_system": "Tb-Tl",
"density": 11.953654825036322,
"density_atomic": 0.0372951170123373,
"volume": 107.25264647049617,
"volume_molar": 16.14726334819613,
"formula_full": "Tb1 Tl3",
"formula_reduced": "TbTl3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-13166",
"created_at": "2022-09-04T14:38:17.478975Z",
"updated_at": "2022-09-04T14:38:17.479007Z",
"structure_string": "Li1 Co1 P2 O7\n1.0\n4.397738 -0.024037 -0.030553\n-0.721752 5.040917 0.038369\n-0.722322 -1.237166 4.886849\nLi Co P O\n1 1 2 7\ndirect\n0.723585 0.083134 0.309116 Li\n0.723655 0.451862 0.940282 Co\n0.132120 0.005301 0.806458 P\n0.315197 0.585686 0.386832 P\n0.465157 0.456882 0.600397 O\n-0.000138 0.397511 0.239875 O\n0.532548 0.681189 0.199975 O\n0.447438 0.152277 0.994644 O\n0.223679 0.872735 0.519421 O\n0.914768 0.192159 0.710967 O\n0.982177 0.791710 0.935236 O\n",
"nsites": 11,
"nelements": 4,
"elements": [
"Li",
"Co",
"P",
"O"
],
"chemical_system": "Co-Li-O-P",
"density": 3.6763586048329646,
"density_atomic": 0.10155014534701909,
"volume": 108.320869087982,
"volume_molar": 5.930213826303277,
"formula_full": "Li1 Co1 P2 O7",
"formula_reduced": "LiCoP2O7",
"formula_anonymous": "ABC2D7",
"energy_above_hull": 2.764733309090909,
"spacegroup": 5
}
]
}