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=density&page=445",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=443",
"results": [
{
"id": "jvasp-49229",
"created_at": "2022-09-04T14:38:36.463768Z",
"updated_at": "2022-09-04T14:38:36.463798Z",
"structure_string": "Ca4 Al6 Te1 O12\n1.0\n7.524552 0.000000 -2.660331\n-3.762276 6.516453 -2.660331\n-0.000000 -0.000000 7.980993\nCa Al Te O\n4 6 1 12\ndirect\n0.610947 -0.000000 -0.000000 Ca\n0.000000 0.000000 0.610947 Ca\n0.389052 0.389053 0.389053 Ca\n-0.000000 0.610947 -0.000000 Ca\n0.499999 0.750000 0.250000 Al\n0.500000 0.250000 0.750000 Al\n0.749999 0.500000 0.250000 Al\n0.250000 0.500000 0.750000 Al\n0.750000 0.250000 0.500000 Al\n0.249999 0.750000 0.500000 Al\n0.000000 0.000000 0.000000 Te\n0.416028 0.715181 -0.000000 O\n-0.000000 0.416028 0.715181 O\n0.715181 0.416028 -0.000000 O\n-0.000001 0.715181 0.416028 O\n0.700846 0.284818 0.284818 O\n0.284818 0.700847 0.284818 O\n0.715181 0.000000 0.416028 O\n0.299153 0.583971 0.583971 O\n0.583971 0.299153 0.583971 O\n0.284818 0.284818 0.700847 O\n0.583971 0.583971 0.299153 O\n0.416028 0.000000 0.715181 O\n",
"nsites": 23,
"nelements": 4,
"elements": [
"Ca",
"Al",
"Te",
"O"
],
"chemical_system": "Al-Ca-O-Te",
"density": 2.7233027620049293,
"density_atomic": 0.0587731531535847,
"volume": 391.33513799909474,
"volume_molar": 10.246414284193797,
"formula_full": "Ca4 Al6 Te1 O12",
"formula_reduced": "Ca4Al6TeO12",
"formula_anonymous": "AB4C6D12",
"energy_above_hull": 1.9769529672463768,
"spacegroup": 217
},
{
"id": "jvasp-85919",
"created_at": "2022-09-04T14:36:11.469325Z",
"updated_at": "2022-09-04T14:36:11.469352Z",
"structure_string": "K2 C2 Br2 N4 O8\n1.0\n5.994702 0.084599 -1.465926\n-1.491209 6.126778 -3.152767\n0.007444 0.003866 7.375603\nK C Br N O\n2 2 2 4 8\ndirect\n0.327966 0.278909 0.127384 K\n0.672033 0.721092 0.872615 K\n0.952538 0.243067 0.537866 C\n0.047461 0.756934 0.462133 C\n0.796733 0.203491 0.711265 Br\n0.203266 0.796510 0.288734 Br\n0.822491 0.638321 0.369386 N\n0.177509 0.361680 0.630613 N\n0.834137 0.158854 0.323780 N\n0.165862 0.841147 0.676219 N\n0.272857 0.421516 0.825496 O\n0.714941 0.587825 0.473385 O\n0.727142 0.578485 0.174503 O\n0.371865 0.945611 0.741789 O\n0.628134 0.054390 0.258210 O\n0.285059 0.412176 0.526614 O\n0.924642 0.179002 0.194291 O\n0.075357 0.820999 0.805708 O\n",
"nsites": 18,
"nelements": 5,
"elements": [
"K",
"C",
"Br",
"N",
"O"
],
"chemical_system": "Br-C-K-N-O",
"density": 2.7233936779105896,
"density_atomic": 0.06618388187390349,
"volume": 271.9695413800963,
"volume_molar": 9.099104781242136,
"formula_full": "K2 C2 Br2 N4 O8",
"formula_reduced": "KCBr(NO2)2",
"formula_anonymous": "ABCD2E4",
"energy_above_hull": 3.234845845,
"spacegroup": 2
},
{
"id": "jvasp-88671",
"created_at": "2022-09-04T14:35:42.382533Z",
"updated_at": "2022-09-04T14:35:42.382561Z",
"structure_string": "Sb1 S24 I3\n1.0\n12.651052 -0.040629 -7.010257\n-11.892353 4.315404 -7.010257\n-0.007211 -0.040629 14.463498\nSb S I\n1 24 3\ndirect\n0.348071 0.348071 0.348071 Sb\n0.443014 0.168783 0.443014 S\n0.761061 0.625495 0.373802 S\n0.625495 0.373802 0.761061 S\n0.373802 0.761061 0.625495 S\n0.373802 0.625495 0.761061 S\n0.625495 0.761061 0.373802 S\n0.761061 0.373802 0.625495 S\n0.616645 0.424839 0.081307 S\n0.424839 0.081308 0.616646 S\n0.081307 0.616645 0.424839 S\n0.081308 0.424839 0.616645 S\n0.424839 0.616645 0.081307 S\n0.616646 0.081308 0.424839 S\n0.867909 0.734526 0.248765 S\n0.734526 0.248766 0.867909 S\n0.248766 0.867909 0.734526 S\n0.248766 0.734526 0.867909 S\n0.734526 0.867909 0.248765 S\n0.867909 0.248766 0.734526 S\n-0.016494 0.585844 0.585844 S\n0.585844 0.585844 -0.016495 S\n0.585845 -0.016494 0.585845 S\n0.443014 0.443014 0.168783 S\n0.168783 0.443014 0.443014 S\n0.118173 0.951064 0.951064 I\n0.951064 0.951064 0.118173 I\n0.951065 0.118173 0.951065 I\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Sb",
"S",
"I"
],
"chemical_system": "I-S-Sb",
"density": 2.723997586925803,
"density_atomic": 0.036109139091953714,
"volume": 775.4269612658616,
"volume_molar": 16.677608249436023,
"formula_full": "Sb1 S24 I3",
"formula_reduced": "Sb(S8I)3",
"formula_anonymous": "AB3C24",
"energy_above_hull": 2.110995175892857,
"spacegroup": 160
},
{
"id": "jvasp-92892",
"created_at": "2022-09-04T14:35:46.009360Z",
"updated_at": "2022-09-04T14:35:46.009389Z",
"structure_string": "Mg6 Cr1 Ga1\n1.0\n6.180791 0.007951 0.000000\n-3.083509 5.340794 0.000000\n0.000000 0.000000 4.936702\nMg Cr Ga\n6 1 1\ndirect\n0.666687 0.331865 0.250000 Mg\n0.666687 0.834820 0.250000 Mg\n0.328010 0.168100 0.750000 Mg\n0.328010 0.659911 0.750000 Mg\n0.841915 0.170958 0.750000 Mg\n0.837507 0.668754 0.750000 Mg\n0.164786 0.332393 0.250000 Cr\n0.166397 0.833197 0.250000 Ga\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Cr",
"Ga"
],
"chemical_system": "Cr-Ga-Mg",
"density": 2.724227424817672,
"density_atomic": 0.04905471487715351,
"volume": 163.0832025022304,
"volume_molar": 12.276375013250195,
"formula_full": "Mg6 Cr1 Ga1",
"formula_reduced": "Mg6CrGa",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0007762499999999,
"spacegroup": 38
},
{
"id": "jvasp-51524",
"created_at": "2022-09-04T14:37:31.786547Z",
"updated_at": "2022-09-04T14:37:31.786563Z",
"structure_string": "Al4 In4 Cl16\n1.0\n7.024115 0.000000 0.000000\n0.000000 9.319269 0.000000\n0.000000 0.000000 10.563486\nAl In Cl\n4 4 16\ndirect\n0.749999 0.812292 0.564978 Al\n0.250000 0.312292 0.935022 Al\n0.250000 0.187708 0.435022 Al\n0.749999 0.687708 0.064978 Al\n0.749999 0.283049 0.694890 In\n0.749999 0.216951 0.194890 In\n0.250000 0.716951 0.305111 In\n0.250000 0.783049 0.805111 In\n-0.001989 0.674884 0.566370 Cl\n0.250000 0.055678 0.602143 Cl\n0.749999 0.555678 0.897857 Cl\n0.250000 0.444322 0.102143 Cl\n0.001989 0.174884 0.933630 Cl\n0.749999 0.944322 0.397857 Cl\n0.498011 0.325116 0.433630 Cl\n0.749999 0.936781 0.737236 Cl\n0.749999 0.563219 0.237236 Cl\n0.501989 0.825116 0.066370 Cl\n0.501989 0.674884 0.566370 Cl\n0.498011 0.174884 0.933630 Cl\n0.250000 0.063219 0.262764 Cl\n0.001989 0.325116 0.433630 Cl\n-0.001989 0.825116 0.066370 Cl\n0.250000 0.436781 0.762765 Cl\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Al",
"In",
"Cl"
],
"chemical_system": "Al-Cl-In",
"density": 2.724283264932208,
"density_atomic": 0.03470807438552578,
"volume": 691.4817495610951,
"volume_molar": 17.350835120116596,
"formula_full": "Al4 In4 Cl16",
"formula_reduced": "AlInCl4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0567631733333334,
"spacegroup": 62
},
{
"id": "jvasp-90776",
"created_at": "2022-09-04T14:36:17.437548Z",
"updated_at": "2022-09-04T14:36:17.437566Z",
"structure_string": "Sr6 Mg2\n1.0\n5.548123 0.000000 -0.000000\n0.000000 5.548123 0.000000\n0.000000 0.000000 11.372119\nSr Mg\n6 2\ndirect\n0.500000 0.500000 0.000000 Sr\n0.500000 0.000000 0.250000 Sr\n0.000000 0.500000 0.250000 Sr\n0.000000 0.000000 0.500000 Sr\n0.000000 0.500000 0.750000 Sr\n0.500000 0.000000 0.750000 Sr\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sr",
"Mg"
],
"chemical_system": "Mg-Sr",
"density": 2.7244387124911267,
"density_atomic": 0.022853695156839625,
"volume": 350.05280087521294,
"volume_molar": 26.350840503784795,
"formula_full": "Sr6 Mg2",
"formula_reduced": "Sr3Mg",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0792486764705882,
"spacegroup": 139
},
{
"id": "jvasp-115198",
"created_at": "2022-09-04T14:38:45.279097Z",
"updated_at": "2022-09-04T14:38:45.279128Z",
"structure_string": "Li2 I1\n1.0\n3.826644 0.376679 0.558687\n-1.303579 -3.614518 -0.581007\n-0.008091 -2.564993 -6.720297\nLi I\n2 1\ndirect\n0.799598 0.634758 0.601260 Li\n0.435711 0.433784 0.166046 Li\n0.117583 0.034197 0.883737 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Li",
"I"
],
"chemical_system": "I-Li",
"density": 2.7246469497936348,
"density_atomic": 0.034964029125736824,
"volume": 85.80246827994193,
"volume_molar": 17.223818051241512,
"formula_full": "Li2 I1",
"formula_reduced": "Li2I",
"formula_anonymous": "AB2",
"energy_above_hull": 0.4565733333333333,
"spacegroup": 12
},
{
"id": "jvasp-94242",
"created_at": "2022-09-04T14:35:47.654445Z",
"updated_at": "2022-09-04T14:35:47.654467Z",
"structure_string": "Ba1 Mg6 Co1\n1.0\n8.097855 -1.110347 0.000000\n-5.010516 6.457774 0.000000\n0.000000 0.000000 4.460337\nBa Mg Co\n1 6 1\ndirect\n0.275853 0.224147 0.750001 Ba\n0.210094 0.796659 0.250000 Mg\n0.703339 0.289905 0.250000 Mg\n0.681376 0.818622 0.250000 Mg\n0.317569 0.661271 0.750001 Mg\n0.838727 0.182429 0.750001 Mg\n0.870650 0.629347 0.750001 Mg\n0.102384 0.397615 0.250000 Co\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Co"
],
"chemical_system": "Ba-Co-Mg",
"density": 2.7253338357474144,
"density_atomic": 0.038381325679406636,
"volume": 208.43469730104638,
"volume_molar": 15.690288580186166,
"formula_full": "Ba1 Mg6 Co1",
"formula_reduced": "BaMg6Co",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-91911",
"created_at": "2022-09-04T14:36:11.066769Z",
"updated_at": "2022-09-04T14:36:11.066796Z",
"structure_string": "Rb1 Mg6 Mo1\n1.0\n6.704745 -1.796482 0.000000\n-4.908172 8.501202 0.000000\n0.000000 0.000000 4.137920\nRb Mg Mo\n1 6 1\ndirect\n0.250091 0.375045 0.250000 Rb\n0.749924 0.374893 0.250000 Mg\n0.749924 0.875032 0.250000 Mg\n0.249955 0.079805 0.750000 Mg\n0.249955 0.670150 0.750000 Mg\n0.659640 0.079821 0.750000 Mg\n0.840426 0.670214 0.750000 Mg\n0.250083 0.875040 0.250000 Mo\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Rb",
"Mg",
"Mo"
],
"chemical_system": "Mg-Mo-Rb",
"density": 2.72555607956641,
"density_atomic": 0.04012661707442086,
"volume": 199.36891228988463,
"volume_molar": 15.007845662222241,
"formula_full": "Rb1 Mg6 Mo1",
"formula_reduced": "RbMg6Mo",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0375000249999999,
"spacegroup": 123
},
{
"id": "jvasp-94247",
"created_at": "2022-09-04T14:35:58.127275Z",
"updated_at": "2022-09-04T14:35:58.127300Z",
"structure_string": "Mg6 V1 Fe1\n1.0\n6.222214 -0.137456 0.000000\n-3.230147 5.319866 0.000000\n0.000000 0.000000 4.712712\nMg V Fe\n6 1 1\ndirect\n0.176901 0.842017 0.250000 Mg\n0.657982 0.323099 0.250000 Mg\n0.670924 0.829075 0.250000 Mg\n0.320207 0.661693 0.750000 Mg\n0.838306 0.179792 0.750000 Mg\n0.831740 0.668259 0.750000 Mg\n0.307388 0.192612 0.750000 V\n0.196548 0.303452 0.250000 Fe\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"V",
"Fe"
],
"chemical_system": "Fe-Mg-V",
"density": 2.7255809279426053,
"density_atomic": 0.05198023725770584,
"volume": 153.90464572791143,
"volume_molar": 11.58544300239269,
"formula_full": "Mg6 V1 Fe1",
"formula_reduced": "Mg6VFe",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.4197879999999999,
"spacegroup": 38
},
{
"id": "jvasp-113630",
"created_at": "2022-09-04T14:38:48.088036Z",
"updated_at": "2022-09-04T14:38:48.088066Z",
"structure_string": "Ge1 H2\n1.0\n6.728344 0.000000 0.000000\n0.000000 2.589188 0.000000\n0.000000 0.000000 2.610688\nGe H\n1 2\ndirect\n0.467169 0.000000 0.000000 Ge\n-0.033585 0.000000 0.857483 H\n-0.033585 0.000000 0.142517 H\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ge",
"H"
],
"chemical_system": "Ge-H",
"density": 2.7257521950061103,
"density_atomic": 0.06596210533267464,
"volume": 45.48065870350466,
"volume_molar": 9.129697619000806,
"formula_full": "Ge1 H2",
"formula_reduced": "GeH2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.8540619833333327,
"spacegroup": 47
},
{
"id": "jvasp-94062",
"created_at": "2022-09-04T14:35:59.533151Z",
"updated_at": "2022-09-04T14:35:59.533177Z",
"structure_string": "Mg6 V1 Cr1\n1.0\n6.260565 -0.193622 0.000000\n-3.297964 5.324996 0.000000\n0.000000 0.000000 4.634460\nMg V Cr\n6 1 1\ndirect\n0.182709 0.840762 0.250000 Mg\n0.659238 0.317292 0.250000 Mg\n0.670875 0.829127 0.250000 Mg\n0.319007 0.658510 0.750000 Mg\n0.841490 0.180994 0.750000 Mg\n0.828081 0.671920 0.750000 Mg\n0.199536 0.300464 0.250000 V\n0.299067 0.200933 0.750000 Cr\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"V",
"Cr"
],
"chemical_system": "Cr-Mg-V",
"density": 2.725902374005699,
"density_atomic": 0.052790693964819946,
"volume": 151.54186086910036,
"volume_molar": 11.40758021482573,
"formula_full": "Mg6 V1 Cr1",
"formula_reduced": "Mg6VCr",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.6301507375000001,
"spacegroup": 38
}
]
}