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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=3803",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=3801",
"results": [
{
"id": "jvasp-9511",
"created_at": "2022-09-04T14:37:09.123380Z",
"updated_at": "2022-09-04T14:37:09.123408Z",
"structure_string": "Mg2 Mn2 Si2 O10\n1.0\n5.044609 -0.288418 0.110981\n-1.483172 5.169285 -0.047282\n-1.486825 -2.257822 6.219795\nMg Mn Si O\n2 2 2 10\ndirect\n0.356522 0.217855 0.771505 Mg\n0.642545 0.783083 0.241251 Mg\n-0.000481 0.500490 0.506472 Mn\n-0.000464 0.500483 0.006466 Mn\n0.693223 0.822481 0.748228 Si\n0.305834 0.178517 0.264696 Si\n0.699687 0.636157 0.909889 O\n0.983671 0.855418 0.661815 O\n0.299371 0.364850 0.103046 O\n0.015378 0.145560 0.351114 O\n0.593432 0.294640 0.477032 O\n0.300476 0.872673 0.126214 O\n0.405586 0.706356 0.535930 O\n0.698584 0.128327 0.886713 O\n0.888292 0.558942 0.255056 O\n0.110756 0.442015 0.757872 O\n",
"nsites": 16,
"nelements": 4,
"elements": [
"Mg",
"Mn",
"Si",
"O"
],
"chemical_system": "Mg-Mn-O-Si",
"density": 3.883440152341981,
"density_atomic": 0.09987585297465404,
"volume": 160.19888214682277,
"volume_molar": 6.029626361767611,
"formula_full": "Mg2 Mn2 Si2 O10",
"formula_reduced": "MgMnSiO5",
"formula_anonymous": "ABCD5",
"energy_above_hull": 2.389649048922413,
"spacegroup": 2
},
{
"id": "jvasp-21346",
"created_at": "2022-09-04T14:37:09.570254Z",
"updated_at": "2022-09-04T14:37:09.570275Z",
"structure_string": "Mg2 Mn2 Si4 O12\n1.0\n5.244419 0.116516 1.206436\n1.449151 6.608522 0.524786\n0.159013 -0.120432 6.782936\nMg Mn Si O\n2 2 4 12\ndirect\n0.750000 0.240039 0.759962 Mg\n0.250001 0.759961 0.240040 Mg\n0.249998 0.105754 0.894248 Mn\n0.749999 0.894249 0.105754 Mn\n0.230877 0.213803 0.386834 Si\n0.269121 0.613166 0.786198 Si\n0.730877 0.386834 0.213803 Si\n0.769122 0.786198 0.613167 Si\n0.658702 0.968606 0.783219 O\n0.841298 0.216782 0.031395 O\n0.623399 0.617895 0.141800 O\n0.876600 0.858202 0.382107 O\n0.376599 0.382105 0.858201 O\n0.026440 0.622100 0.672804 O\n0.973558 0.377901 0.327197 O\n0.526441 0.672804 0.622102 O\n0.341297 0.031395 0.216783 O\n0.473559 0.327198 0.377900 O\n0.123400 0.141799 0.617895 O\n0.158702 0.783218 0.968607 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Mg",
"Mn",
"Si",
"O"
],
"chemical_system": "Mg-Mn-O-Si",
"density": 3.301260801408675,
"density_atomic": 0.08591080337114335,
"volume": 232.7995923120167,
"volume_molar": 7.009759568867893,
"formula_full": "Mg2 Mn2 Si4 O12",
"formula_reduced": "MgMn(SiO3)2",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.6241974491379305,
"spacegroup": 15
},
{
"id": "jvasp-87910",
"created_at": "2022-09-04T14:37:40.573614Z",
"updated_at": "2022-09-04T14:37:40.573643Z",
"structure_string": "Mg12 Mn8 Si12 O48\n1.0\n9.564288 0.000000 -3.381486\n-4.782145 8.282917 -3.381486\n-0.000000 -0.000000 10.144460\nMg Mn Si O\n12 8 12 48\ndirect\n0.250000 0.875000 0.625000 Mg\n0.250000 0.375000 0.125000 Mg\n0.375001 0.750000 0.125000 Mg\n0.125000 0.250000 0.375000 Mg\n0.375000 0.125000 0.250000 Mg\n0.125000 0.375000 0.750000 Mg\n0.750000 0.125000 0.375000 Mg\n0.750001 0.625000 0.875000 Mg\n0.625000 0.250000 0.875000 Mg\n0.875001 0.750000 0.625000 Mg\n0.625001 0.875000 0.750000 Mg\n0.875002 0.625000 0.250000 Mg\n1.000000 0.500000 0.500000 Mn\n0.500000 0.500000 -0.000000 Mn\n1.000000 0.500000 0.999999 Mn\n0.000000 0.000000 0.500000 Mn\n0.500000 0.000000 0.999999 Mn\n0.500000 -0.000000 0.500000 Mn\n0.500000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.375000 0.625000 0.750000 Si\n0.125001 0.875000 0.250000 Si\n0.625000 0.375000 0.250000 Si\n0.375001 0.250000 0.625000 Si\n0.750001 0.375000 0.625000 Si\n0.125001 0.750000 0.875000 Si\n0.250000 0.125000 0.875000 Si\n0.875000 0.250000 0.125000 Si\n0.625001 0.750000 0.375000 Si\n0.250000 0.625000 0.375000 Si\n0.750001 0.875000 0.125000 Si\n0.875000 0.125000 0.749999 Si\n0.191207 0.213459 0.589289 O\n0.786542 0.410710 0.808792 O\n0.022252 0.308793 0.898082 O\n0.124170 0.601919 0.910711 O\n0.213459 0.589290 0.191208 O\n0.213459 0.124170 0.022252 O\n0.589290 0.191208 0.213459 O\n0.601918 0.191208 0.477749 O\n0.713459 0.691208 0.089289 O\n0.910712 0.286542 0.308793 O\n0.808793 0.786542 0.410710 O\n0.101918 0.624169 0.410710 O\n0.691208 0.089289 0.713458 O\n0.089289 0.713458 0.691207 O\n0.977750 0.786542 0.875831 O\n0.808794 0.522252 0.398083 O\n0.410710 0.101918 0.624169 O\n0.398082 0.808793 0.522251 O\n0.875832 0.977749 0.786541 O\n0.624169 0.410710 0.101918 O\n0.101919 0.977749 0.691208 O\n0.398082 0.089289 0.875830 O\n0.089290 0.875832 0.398082 O\n0.522251 0.624169 0.713458 O\n0.624169 0.713458 0.522251 O\n0.691207 0.101918 0.977748 O\n0.522251 0.398082 0.808792 O\n0.308793 0.910711 0.286541 O\n0.410712 0.808793 0.786541 O\n0.286542 0.477749 0.375831 O\n0.022251 0.213459 0.124169 O\n0.191208 0.477749 0.601919 O\n0.589289 0.898082 0.375831 O\n0.124170 0.022252 0.213459 O\n0.477750 0.601919 0.191208 O\n0.375832 0.589290 0.898082 O\n0.898082 0.022252 0.308792 O\n0.786542 0.875832 0.977748 O\n0.601919 0.910711 0.124170 O\n0.477748 0.375830 0.286540 O\n0.375830 0.286542 0.477749 O\n0.308793 0.898082 0.022252 O\n0.286542 0.308793 0.910711 O\n0.713459 0.522252 0.624170 O\n0.977750 0.691208 0.101918 O\n0.875832 0.398082 0.089290 O\n0.910711 0.124170 0.601918 O\n0.898082 0.375830 0.589288 O\n",
"nsites": 80,
"nelements": 4,
"elements": [
"Mg",
"Mn",
"Si",
"O"
],
"chemical_system": "Mg-Mn-O-Si",
"density": 3.793980549079842,
"density_atomic": 0.09954629445638383,
"volume": 803.646187302853,
"volume_molar": 6.049588076468881,
"formula_full": "Mg12 Mn8 Si12 O48",
"formula_reduced": "Mg3Mn2(SiO4)3",
"formula_anonymous": "A2B3C3D12",
"energy_above_hull": 2.666210971637931,
"spacegroup": 230
},
{
"id": "jvasp-58075",
"created_at": "2022-09-04T14:36:49.384864Z",
"updated_at": "2022-09-04T14:36:49.384902Z",
"structure_string": "Y2 Mg1 Mn2 S2 O5\n1.0\n-3.899011 -0.000054 -0.001046\n-0.000072 -3.939350 -0.001011\n1.947103 1.966597 11.074481\nY Mg Mn S O\n2 1 2 2 5\ndirect\n0.662690 0.663965 0.325498 Y\n0.336971 0.338151 0.673856 Y\n0.998323 0.501063 0.999671 Mg\n0.907819 0.908957 0.815459 Mn\n0.091901 0.093161 0.183890 Mn\n0.795274 0.796440 0.590456 S\n0.204428 0.205662 0.408901 S\n0.396960 0.898154 0.793843 O\n0.602674 0.103972 0.205513 O\n0.907402 0.408728 0.814989 O\n0.091943 0.593399 0.184355 O\n0.999429 0.001057 -0.000331 O\n",
"nsites": 12,
"nelements": 5,
"elements": [
"Y",
"Mg",
"Mn",
"S",
"O"
],
"chemical_system": "Mg-Mn-O-S-Y",
"density": 4.453135197209114,
"density_atomic": 0.07055358941607291,
"volume": 170.08347979622795,
"volume_molar": 8.535555469029173,
"formula_full": "Y2 Mg1 Mn2 S2 O5",
"formula_reduced": "Y2MgMn2S2O5",
"formula_anonymous": "AB2C2D2E5",
"energy_above_hull": 2.779901827729885,
"spacegroup": 71
},
{
"id": "jvasp-109565",
"created_at": "2022-09-04T14:38:28.214713Z",
"updated_at": "2022-09-04T14:38:28.214732Z",
"structure_string": "Mg1 Mn1 Pd2\n1.0\n3.833401 -0.000000 2.213215\n1.277800 3.614165 2.213215\n-0.000000 -0.000000 4.426431\nMg Mn Pd\n1 1 2\ndirect\n0.500000 0.500001 0.500001 Mg\n0.000000 0.000000 0.000000 Mn\n0.250000 0.250000 0.250000 Pd\n0.749999 0.750001 0.750001 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Mn",
"Pd"
],
"chemical_system": "Mg-Mn-Pd",
"density": 7.908780432664344,
"density_atomic": 0.06522499657163945,
"volume": 61.32618183592584,
"volume_molar": 9.232872482232516,
"formula_full": "Mg1 Mn1 Pd2",
"formula_reduced": "MgMnPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.5656319228448274,
"spacegroup": 225
},
{
"id": "jvasp-79431",
"created_at": "2022-09-04T14:36:44.843504Z",
"updated_at": "2022-09-04T14:36:44.843527Z",
"structure_string": "Mg1 Mn1 Pt2\n1.0\n-0.000169 3.132696 3.132684\n3.132606 -0.000048 3.132562\n3.132777 3.132745 -0.000219\nMg Mn Pt\n1 1 2\ndirect\n0.250000 0.249999 0.249999 Mg\n0.749999 0.750000 0.750003 Mn\n0.000000 0.000000 0.999999 Pt\n0.499999 0.500000 0.500004 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Mn",
"Pt"
],
"chemical_system": "Mg-Mn-Pt",
"density": 12.676366161530904,
"density_atomic": 0.06505075855334515,
"volume": 61.49044360058896,
"volume_molar": 9.257602668939699,
"formula_full": "Mg1 Mn1 Pt2",
"formula_reduced": "MgMnPt2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.0121372728448272,
"spacegroup": 225
},
{
"id": "jvasp-38842",
"created_at": "2022-09-04T14:35:47.700086Z",
"updated_at": "2022-09-04T14:35:47.700107Z",
"structure_string": "Mg1 Mn1 Rh2\n1.0\n0.000001 3.057642 3.057637\n3.057639 0.000003 3.057636\n3.057640 3.057641 0.000002\nMg Mn Rh\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Mg\n0.750000 0.750001 0.749999 Mn\n0.000001 0.000000 -0.000000 Rh\n0.500000 0.500003 0.499999 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Mn",
"Rh"
],
"chemical_system": "Mg-Mn-Rh",
"density": 8.279193588239211,
"density_atomic": 0.06996353156103578,
"volume": 57.17264281478448,
"volume_molar": 8.60754256629587,
"formula_full": "Mg1 Mn1 Rh2",
"formula_reduced": "MgMnRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.214833072844828,
"spacegroup": 225
},
{
"id": "jvasp-10818",
"created_at": "2022-09-04T14:36:43.479375Z",
"updated_at": "2022-09-04T14:36:43.479390Z",
"structure_string": "Mg1 Mn4 S8\n1.0\n6.878561 0.006076 0.004296\n3.444542 5.966120 0.000000\n3.444542 1.988707 5.624914\nMg Mn S\n1 4 8\ndirect\n0.500000 0.000000 0.000000 Mg\n-0.000000 0.500000 0.500000 Mn\n0.499999 0.500000 0.000000 Mn\n0.499999 0.500001 0.500000 Mn\n0.499999 0.000001 0.500000 Mn\n0.259321 0.256848 0.256848 S\n0.259320 0.256849 0.726984 S\n0.259321 0.726984 0.256848 S\n0.727599 0.257467 0.257467 S\n0.272400 0.742534 0.742533 S\n0.740678 0.743153 0.273016 S\n0.740678 0.273017 0.743152 S\n0.740678 0.743153 0.743152 S\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Mg",
"Mn",
"S"
],
"chemical_system": "Mg-Mn-S",
"density": 3.603686685270733,
"density_atomic": 0.056359902433984824,
"volume": 230.66044188467305,
"volume_molar": 10.685151144563852,
"formula_full": "Mg1 Mn4 S8",
"formula_reduced": "Mg(MnS2)4",
"formula_anonymous": "AB4C8",
"energy_above_hull": 2.8971498473474804,
"spacegroup": 166
},
{
"id": "jvasp-57990",
"created_at": "2022-09-04T14:37:09.127341Z",
"updated_at": "2022-09-04T14:37:09.127360Z",
"structure_string": "Mg2 Mn4 S8\n1.0\n6.430748 -0.000000 -3.376225\n-1.772561 6.181631 -3.376225\n-0.297823 -0.395225 7.245218\nMg Mn S\n2 4 8\ndirect\n0.375001 0.625001 0.750002 Mg\n0.625000 0.375000 0.250001 Mg\n0.000000 0.000000 0.500001 Mn\n0.000000 0.500000 0.000000 Mn\n0.500001 0.000000 0.500001 Mn\n0.000000 0.000000 0.000000 Mn\n0.761505 0.784585 0.523010 S\n0.761578 0.238497 0.976994 S\n0.215417 0.238497 0.976994 S\n0.238497 0.215416 0.476993 S\n0.238497 0.761578 0.476993 S\n0.238423 0.761504 0.023009 S\n0.761505 0.238423 0.523009 S\n0.784585 0.761504 0.023009 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mg",
"Mn",
"S"
],
"chemical_system": "Mg-Mn-S",
"density": 3.2179275246056815,
"density_atomic": 0.05168843324322984,
"volume": 270.8536343928305,
"volume_molar": 11.650847940508587,
"formula_full": "Mg2 Mn4 S8",
"formula_reduced": "Mg(MnS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.359650504679802,
"spacegroup": 227
},
{
"id": "jvasp-59897",
"created_at": "2022-09-04T14:37:15.535129Z",
"updated_at": "2022-09-04T14:37:15.535154Z",
"structure_string": "Mg2 Mn4 S8\n1.0\n7.023806 0.002119 0.002678\n3.510642 6.200919 -0.000032\n3.508587 1.879520 5.909955\nMg Mn S\n2 4 8\ndirect\n0.000001 -0.000004 0.999998 Mg\n-0.000008 0.500003 0.500015 Mg\n-0.000002 -0.000002 0.500007 Mn\n0.499991 0.000010 0.000010 Mn\n0.499998 0.999996 0.500009 Mn\n0.500003 0.499998 0.499993 Mn\n0.746312 0.225079 0.282211 S\n0.758702 0.238552 0.738483 S\n0.746398 0.782215 0.725086 S\n0.735747 0.761518 0.261457 S\n0.253593 0.217788 0.274938 S\n0.241290 0.761451 0.261525 S\n0.264250 0.238480 0.738554 S\n0.253692 0.774909 0.717795 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mg",
"Mn",
"S"
],
"chemical_system": "Mg-Mn-S",
"density": 3.3871947265021713,
"density_atomic": 0.05440731252145944,
"volume": 257.3183520961101,
"volume_molar": 11.0686238318144,
"formula_full": "Mg2 Mn4 S8",
"formula_reduced": "Mg(MnS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.358544790394088,
"spacegroup": 74
},
{
"id": "jvasp-99963",
"created_at": "2022-09-04T14:36:38.438863Z",
"updated_at": "2022-09-04T14:36:38.438881Z",
"structure_string": "Mg5 Mn1 Sb4\n1.0\n4.537737 -0.000000 -0.000000\n-2.268867 3.929796 0.000000\n-0.000000 0.000000 14.521290\nMg Mn Sb\n5 1 4\ndirect\n0.666667 0.333333 0.998265 Mg\n0.666667 0.333333 0.502624 Mg\n0.000000 -0.000000 0.184320 Mg\n0.333333 0.666668 0.811658 Mg\n0.333333 0.666668 0.316203 Mg\n0.000000 -0.000000 0.687336 Mn\n0.000000 -0.000000 0.882993 Sb\n0.000000 -0.000000 0.388433 Sb\n0.333333 0.666668 0.615796 Sb\n0.333333 0.666668 0.112373 Sb\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Mg",
"Mn",
"Sb"
],
"chemical_system": "Mg-Mn-Sb",
"density": 4.254783746860855,
"density_atomic": 0.038617617249685716,
"volume": 258.94917170430506,
"volume_molar": 15.594283616887342,
"formula_full": "Mg5 Mn1 Sb4",
"formula_reduced": "Mg5MnSb4",
"formula_anonymous": "AB4C5",
"energy_above_hull": 0.742567689137931,
"spacegroup": 156
},
{
"id": "jvasp-113132",
"created_at": "2022-09-04T14:38:46.544943Z",
"updated_at": "2022-09-04T14:38:46.544977Z",
"structure_string": "Sm2 Mg2 Mn2 S8\n1.0\n6.722572 -0.000830 4.046217\n2.303770 6.179938 3.772421\n0.011081 -0.014425 7.602307\nSm Mg Mn S\n2 2 2 8\ndirect\n0.500002 0.500005 0.499993 Sm\n-0.000003 0.499997 0.500007 Sm\n0.874291 0.875874 0.875625 Mg\n0.125712 0.124124 0.124373 Mg\n0.499997 0.499999 -0.000002 Mn\n0.500001 0.000005 0.499998 Mn\n0.708845 0.761082 0.761056 S\n0.270870 0.227845 0.729828 S\n0.271489 0.729726 0.227896 S\n0.730793 0.238679 0.239232 S\n0.728501 0.270277 0.772104 S\n0.269209 0.761318 0.760771 S\n0.291154 0.238910 0.238955 S\n0.729137 0.772161 0.270169 S\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Sm",
"Mg",
"Mn",
"S"
],
"chemical_system": "Mg-Mn-S-Sm",
"density": 3.763343817808624,
"density_atomic": 0.04433084266878106,
"volume": 315.8072158610052,
"volume_molar": 13.584539335276272,
"formula_full": "Sm2 Mg2 Mn2 S8",
"formula_reduced": "SmMgMnS4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.8425850237684729,
"spacegroup": 74
}
]
}