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=-created_at&page=4538",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-created_at&page=4536",
"results": [
{
"id": "jvasp-66870",
"created_at": "2022-09-04T14:35:44.254588Z",
"updated_at": "2022-09-04T14:35:44.254616Z",
"structure_string": "Mg1 Be2 Cu1\n1.0\n2.798008 0.000000 0.000000\n0.000000 2.798008 0.000000\n0.000000 0.000000 6.031401\nMg Be Cu\n1 2 1\ndirect\n0.500000 0.500000 0.757514 Mg\n0.000000 0.000000 0.059768 Be\n0.500000 0.500000 0.237364 Be\n0.000000 0.000000 0.445355 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Be",
"Cu"
],
"chemical_system": "Be-Cu-Mg",
"density": 3.7232989381871464,
"density_atomic": 0.08471179491791944,
"volume": 47.218926288549966,
"volume_molar": 7.108975516142808,
"formula_full": "Mg1 Be2 Cu1",
"formula_reduced": "MgBe2Cu",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.663171865625,
"spacegroup": 99
},
{
"id": "jvasp-65132",
"created_at": "2022-09-04T14:35:44.254243Z",
"updated_at": "2022-09-04T14:35:44.254268Z",
"structure_string": "Li1 Be2 Ni1\n1.0\n2.612780 0.000000 0.000000\n0.000000 2.612780 0.000000\n0.000000 0.000000 5.863524\nLi Be Ni\n1 2 1\ndirect\n0.000000 0.000000 0.499749 Li\n0.000000 0.000000 0.000746 Be\n0.500000 0.500000 0.203111 Be\n0.500000 0.500000 0.796392 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Be",
"Ni"
],
"chemical_system": "Be-Li-Ni",
"density": 3.4705327595849402,
"density_atomic": 0.09992993345029272,
"volume": 40.02804627093728,
"volume_molar": 6.026363224784435,
"formula_full": "Li1 Be2 Ni1",
"formula_reduced": "LiBe2Ni",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3399761499999998,
"spacegroup": 99
},
{
"id": "jvasp-94795",
"created_at": "2022-09-04T14:35:44.253111Z",
"updated_at": "2022-09-04T14:35:44.253143Z",
"structure_string": "Hf2 Au6\n1.0\n0.000000 4.842190 0.000000\n0.000000 -0.000000 4.934712\n6.110951 0.000000 0.000000\nHf Au\n2 6\ndirect\n0.750000 0.337956 0.750000 Hf\n0.250000 0.662044 0.250000 Hf\n0.750000 0.835207 0.001272 Au\n0.750000 0.835207 0.498728 Au\n0.250000 0.164793 0.998728 Au\n0.250000 0.164793 0.501272 Au\n0.250000 0.654804 0.750000 Au\n0.750000 0.345195 0.250000 Au\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Hf",
"Au"
],
"chemical_system": "Au-Hf",
"density": 17.49899172573349,
"density_atomic": 0.05478700346941863,
"volume": 146.02003200385823,
"volume_molar": 10.991914831336741,
"formula_full": "Hf2 Au6",
"formula_reduced": "HfAu3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.5619889274999998,
"spacegroup": 59
},
{
"id": "jvasp-85300",
"created_at": "2022-09-04T14:35:44.250928Z",
"updated_at": "2022-09-04T14:35:44.250954Z",
"structure_string": "Ce2 Zn1 Ni2\n1.0\n4.014665 0.000000 1.770102\n1.317594 4.430476 2.449408\n0.093107 -0.197010 5.226595\nCe Zn Ni\n2 1 2\ndirect\n0.799174 0.700827 0.700825 Ce\n0.200826 0.299174 0.299173 Ce\n0.000000 0.000000 0.000000 Zn\n0.500000 0.732012 0.267988 Ni\n0.500001 0.267989 0.732010 Ni\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ce",
"Zn",
"Ni"
],
"chemical_system": "Ce-Ni-Zn",
"density": 8.204627853132717,
"density_atomic": 0.05335470551882271,
"volume": 93.71244675384963,
"volume_molar": 11.286990906313752,
"formula_full": "Ce2 Zn1 Ni2",
"formula_reduced": "Ce2ZnNi2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.9565472399999998,
"spacegroup": 71
},
{
"id": "jvasp-88701",
"created_at": "2022-09-04T14:35:44.241593Z",
"updated_at": "2022-09-04T14:35:44.241630Z",
"structure_string": "Rb2 Au2 N24\n1.0\n7.457833 0.007105 -0.079539\n-0.208161 7.454930 -0.079539\n-0.052294 -0.053826 7.884850\nRb Au N\n2 2 24\ndirect\n0.922267 0.077734 0.250000 Rb\n0.077733 0.922267 0.750000 Rb\n0.488043 0.511958 0.750000 Au\n0.511958 0.488043 0.250000 Au\n0.248407 0.474332 0.318521 N\n0.223456 0.534579 0.821057 N\n0.776544 0.465421 0.178942 N\n0.919885 0.280523 0.584320 N\n0.465421 0.776544 0.678942 N\n0.719477 0.080115 0.915679 N\n0.842880 0.592684 0.106468 N\n0.709830 0.913731 0.537677 N\n0.290170 0.086269 0.462323 N\n0.592684 0.842880 0.606468 N\n0.534580 0.223456 0.321057 N\n0.086270 0.290169 0.962323 N\n0.169798 0.605278 0.367880 N\n0.605278 0.169798 0.867880 N\n0.913730 0.709831 0.037677 N\n0.394722 0.830202 0.132120 N\n0.474333 0.248407 0.818521 N\n0.525668 0.751593 0.181479 N\n0.830202 0.394723 0.632120 N\n0.407317 0.157120 0.393531 N\n0.157120 0.407316 0.893531 N\n0.280523 0.919886 0.084320 N\n0.751593 0.525668 0.681479 N\n0.080115 0.719477 0.415679 N\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Rb",
"Au",
"N"
],
"chemical_system": "Au-N-Rb",
"density": 3.413423079148829,
"density_atomic": 0.0638792819873989,
"volume": 438.32678027789046,
"volume_molar": 9.427377034682316,
"formula_full": "Rb2 Au2 N24",
"formula_reduced": "RbAuN12",
"formula_anonymous": "ABC12",
"energy_above_hull": 5.450112612142858,
"spacegroup": 15
},
{
"id": "jvasp-69242",
"created_at": "2022-09-04T14:35:44.235763Z",
"updated_at": "2022-09-04T14:35:44.235780Z",
"structure_string": "Ba2 Pb1 Cl1\n1.0\n-0.000000 4.189987 4.189987\n4.189987 0.000000 4.189987\n4.189987 4.189987 -0.000000\nBa Pb Cl\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750001 0.750001 0.750001 Ba\n0.500000 0.500000 0.500000 Pb\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Pb",
"Cl"
],
"chemical_system": "Ba-Cl-Pb",
"density": 5.83887839540485,
"density_atomic": 0.027188920768365692,
"volume": 147.11874862844869,
"volume_molar": 22.149245316889374,
"formula_full": "Ba2 Pb1 Cl1",
"formula_reduced": "Ba2PbCl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-90802",
"created_at": "2022-09-04T14:35:44.233855Z",
"updated_at": "2022-09-04T14:35:44.233887Z",
"structure_string": "Bi8\n1.0\n5.763956 3.397402 0.000000\n-5.763956 3.397402 0.000000\n0.000000 0.000000 6.683900\nBi\n8\ndirect\n0.296385 0.703615 0.500000 Bi\n0.796385 0.203615 -0.000000 Bi\n0.703615 0.296385 0.500000 Bi\n0.203615 0.796385 -0.000000 Bi\n0.315851 0.315851 0.840838 Bi\n0.684149 0.684149 0.159162 Bi\n0.184149 0.184149 0.340838 Bi\n0.815851 0.815851 0.659162 Bi\n",
"nsites": 8,
"nelements": 1,
"elements": [
"Bi"
],
"chemical_system": "Bi",
"density": 10.605157097325435,
"density_atomic": 0.03056064054048965,
"volume": 261.77461789129836,
"volume_molar": 19.705544954207664,
"formula_full": "Bi8",
"formula_reduced": "Bi",
"formula_anonymous": "A",
"energy_above_hull": 0.0822743000000001,
"spacegroup": 64
},
{
"id": "jvasp-66961",
"created_at": "2022-09-04T14:35:44.229069Z",
"updated_at": "2022-09-04T14:35:44.229101Z",
"structure_string": "Be2 Rh1 Se1\n1.0\n3.099905 -0.000000 0.000000\n-0.000000 3.099905 -0.000000\n0.000000 -0.000000 5.143198\nBe Rh Se\n2 1 1\ndirect\n0.000000 0.000000 0.776181 Be\n0.000000 0.000000 0.223819 Be\n0.499999 0.499999 0.000000 Rh\n0.499999 0.499999 0.500000 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Rh",
"Se"
],
"chemical_system": "Be-Rh-Se",
"density": 6.715987155782456,
"density_atomic": 0.08093380864664713,
"volume": 49.42310348279537,
"volume_molar": 7.440822149235999,
"formula_full": "Be2 Rh1 Se1",
"formula_reduced": "Be2RhSe",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.9588446416666665,
"spacegroup": 123
},
{
"id": "jvasp-97604",
"created_at": "2022-09-04T14:35:44.224820Z",
"updated_at": "2022-09-04T14:35:44.224850Z",
"structure_string": "Ca2 Cu2 H8 C8 O16\n1.0\n6.449989 0.052914 0.000000\n-0.901024 7.249171 0.000000\n0.000000 0.000000 8.337046\nCa Cu H C O\n2 2 8 8 16\ndirect\n0.750000 -0.000000 0.136462 Ca\n0.250000 -0.000000 0.863538 Ca\n0.750000 0.499999 0.405196 Cu\n0.250000 0.500000 0.594805 Cu\n0.722825 0.847186 0.552689 H\n0.777176 0.152813 0.552689 H\n0.907134 0.433103 0.846414 H\n0.222825 0.847186 0.447311 H\n0.277176 0.152813 0.447311 H\n0.092867 0.566896 0.153586 H\n0.407134 0.433103 0.153586 H\n0.592867 0.566896 0.846414 H\n0.504018 0.318125 0.142765 C\n0.629767 0.191055 0.602437 C\n0.870234 0.808944 0.602437 C\n0.370234 0.808944 0.397564 C\n0.495983 0.681874 0.857235 C\n0.004018 0.318125 0.857235 C\n0.129767 0.191055 0.397564 C\n0.995983 0.681874 0.142765 C\n0.037505 0.805906 0.038919 O\n0.913899 0.644711 0.571321 O\n0.158739 0.314812 0.761702 O\n0.086101 0.355288 0.428680 O\n0.413899 0.644712 0.428680 O\n0.537505 0.805906 0.961081 O\n0.586101 0.355288 0.571321 O\n0.658739 0.314812 0.238298 O\n0.841261 0.685187 0.238298 O\n0.341261 0.685188 0.761702 O\n0.462496 0.194093 0.038919 O\n0.016766 0.075845 0.316090 O\n0.983235 0.924154 0.683910 O\n0.516766 0.075845 0.683910 O\n0.962496 0.194093 0.961081 O\n0.483235 0.924154 0.316090 O\n",
"nsites": 36,
"nelements": 5,
"elements": [
"Ca",
"Cu",
"H",
"C",
"O"
],
"chemical_system": "C-Ca-Cu-H-O",
"density": 2.4144974381375124,
"density_atomic": 0.09225722199835147,
"volume": 390.2133537105992,
"volume_molar": 6.527554840213603,
"formula_full": "Ca2 Cu2 H8 C8 O16",
"formula_reduced": "CaCuH4(CO2)4",
"formula_anonymous": "ABC4D4E8",
"energy_above_hull": 3.623857159444444,
"spacegroup": 13
},
{
"id": "jvasp-67498",
"created_at": "2022-09-04T14:35:44.223376Z",
"updated_at": "2022-09-04T14:35:44.223395Z",
"structure_string": "Be1 Re1 Bi1\n1.0\n-1.640027 1.640027 4.715968\n1.640027 -1.640027 4.715968\n1.640027 1.640027 -4.715968\nBe Re Bi\n1 1 1\ndirect\n0.048554 0.048554 0.000000 Be\n0.627147 0.627147 0.000000 Re\n0.324299 0.324299 0.000000 Bi\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Re",
"Bi"
],
"chemical_system": "Be-Bi-Re",
"density": 13.228546270596452,
"density_atomic": 0.0591273503983251,
"volume": 50.73794072945608,
"volume_molar": 10.185034031510721,
"formula_full": "Be1 Re1 Bi1",
"formula_reduced": "BeReBi",
"formula_anonymous": "ABC",
"energy_above_hull": 3.0380628,
"spacegroup": 107
},
{
"id": "jvasp-85705",
"created_at": "2022-09-04T14:35:44.220865Z",
"updated_at": "2022-09-04T14:35:44.220894Z",
"structure_string": "Y2 H2 C1\n1.0\n3.662741 -0.000035 -0.000018\n-1.831401 3.172079 0.000000\n-0.000031 -0.000018 6.003927\nY H C\n2 2 1\ndirect\n0.666675 0.333337 0.774516 Y\n0.333324 0.666661 0.225484 Y\n0.666665 0.333331 0.389094 H\n0.333335 0.666667 0.610906 H\n0.000000 0.000000 0.000000 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Y",
"H",
"C"
],
"chemical_system": "C-H-Y",
"density": 4.5666860687219835,
"density_atomic": 0.07167815078950523,
"volume": 69.75626386739982,
"volume_molar": 8.401640798023674,
"formula_full": "Y2 H2 C1",
"formula_reduced": "Y2H2C",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.4873641800000006,
"spacegroup": 164
},
{
"id": "jvasp-68748",
"created_at": "2022-09-04T14:35:44.220346Z",
"updated_at": "2022-09-04T14:35:44.220376Z",
"structure_string": "Sc2 Be1 Cl1\n1.0\n-1.871772 1.871772 5.256563\n1.871772 -1.871772 5.256563\n1.871772 1.871772 -5.256563\nSc Be Cl\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.250000 0.749999 0.499999 Sc\n0.500000 0.500000 0.000000 Be\n0.749999 0.250000 0.499999 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Be",
"Cl"
],
"chemical_system": "Be-Cl-Sc",
"density": 3.0290490092841273,
"density_atomic": 0.05429905026802393,
"volume": 73.66611350024942,
"volume_molar": 11.090692618515956,
"formula_full": "Sc2 Be1 Cl1",
"formula_reduced": "Sc2BeCl",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.733875166875,
"spacegroup": 119
}
]
}