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=energy_above_hull&page=282",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=280",
"results": [
{
"id": "jvasp-81079",
"created_at": "2022-09-04T14:37:18.215106Z",
"updated_at": "2022-09-04T14:37:18.215126Z",
"structure_string": "Rb2 Hg1 Te1\n1.0\n-14.190831 3.591013 -2.328982\n-10.348295 0.833689 1.442844\n-8.600071 5.778414 -1.585171\nRb Hg Te\n2 1 1\ndirect\n0.749802 0.000164 0.000163 Rb\n0.250198 -0.000163 -0.000164 Rb\n0.500000 0.000000 -0.000000 Hg\n0.000000 0.000000 0.000000 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Rb",
"Hg",
"Te"
],
"chemical_system": "Hg-Rb-Te",
"density": 5.307174748789198,
"density_atomic": 0.025613235134540144,
"volume": 156.16926089144792,
"volume_molar": 23.511831786836563,
"formula_full": "Rb2 Hg1 Te1",
"formula_reduced": "Rb2HgTe",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-102937",
"created_at": "2022-09-04T14:37:13.098247Z",
"updated_at": "2022-09-04T14:37:13.098275Z",
"structure_string": "Er1 Lu1 Zn2\n1.0\n4.277732 -0.000000 2.469750\n1.425911 4.033084 2.469750\n-0.000000 0.000000 4.939499\nEr Lu Zn\n1 1 2\ndirect\n0.500000 0.499999 0.500000 Er\n0.000000 0.000000 0.000000 Lu\n0.250000 0.250000 0.250000 Zn\n0.750000 0.749999 0.750001 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Er",
"Lu",
"Zn"
],
"chemical_system": "Er-Lu-Zn",
"density": 9.217579541531682,
"density_atomic": 0.04693818036781608,
"volume": 85.21847179961549,
"volume_molar": 12.829940813234375,
"formula_full": "Er1 Lu1 Zn2",
"formula_reduced": "ErLuZn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-56928",
"created_at": "2022-09-04T14:37:18.464561Z",
"updated_at": "2022-09-04T14:37:18.464587Z",
"structure_string": "Ba4 Bi2\n1.0\n5.102975 0.000000 -1.382491\n-0.374543 5.089212 -1.382491\n0.062322 0.067077 10.339203\nBa Bi\n4 2\ndirect\n0.500000 -0.000000 0.000000 Ba\n0.679732 0.679731 0.359461 Ba\n0.320269 0.320269 0.640538 Ba\n0.000000 0.500000 0.000000 Ba\n0.865344 0.865343 0.730687 Bi\n0.134657 0.134657 0.269313 Bi\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ba",
"Bi"
],
"chemical_system": "Ba-Bi",
"density": 5.960835563381579,
"density_atomic": 0.022267020804746105,
"volume": 269.45679229442,
"volume_molar": 27.045112198918005,
"formula_full": "Ba4 Bi2",
"formula_reduced": "Ba2Bi",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-35831",
"created_at": "2022-09-04T14:37:29.082237Z",
"updated_at": "2022-09-04T14:37:29.082261Z",
"structure_string": "Ba2 Mg2 Sn2\n1.0\n4.940759 0.000000 0.000000\n0.000000 4.940759 0.000000\n0.000000 -0.000000 8.457488\nBa Mg Sn\n2 2 2\ndirect\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.000000 Ba\n0.500000 0.000000 0.639565 Mg\n0.000000 0.500000 0.360435 Mg\n0.500000 0.000000 0.301706 Sn\n0.000000 0.500000 0.698294 Sn\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Sn"
],
"chemical_system": "Ba-Mg-Sn",
"density": 4.509605270320382,
"density_atomic": 0.02906180064274233,
"volume": 206.4565810549111,
"volume_molar": 20.72184319901707,
"formula_full": "Ba2 Mg2 Sn2",
"formula_reduced": "BaMgSn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 129
},
{
"id": "jvasp-37670",
"created_at": "2022-09-04T14:37:29.970477Z",
"updated_at": "2022-09-04T14:37:29.970496Z",
"structure_string": "Sm2 Zn2 In2\n1.0\n2.350822 -4.071743 0.000000\n2.350822 4.071743 -0.000000\n0.000000 0.000000 7.420952\nSm Zn In\n2 2 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.000000 0.000000 0.500000 Sm\n0.666666 0.333333 0.250000 Zn\n0.333333 0.666666 0.750000 Zn\n0.666666 0.333333 0.750000 In\n0.333333 0.666666 0.250000 In\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sm",
"Zn",
"In"
],
"chemical_system": "In-Sm-Zn",
"density": 7.728142856915962,
"density_atomic": 0.04223393307705961,
"volume": 142.06585943706594,
"volume_molar": 14.259010045339755,
"formula_full": "Sm2 Zn2 In2",
"formula_reduced": "SmZnIn",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-24628",
"created_at": "2022-09-04T14:37:18.173195Z",
"updated_at": "2022-09-04T14:37:18.173205Z",
"structure_string": "Hg6 Se4 Cl4\n1.0\n7.499708 -0.000000 -2.651548\n-3.749854 6.494937 -2.651548\n0.000000 0.000000 7.954642\nHg Se Cl\n6 4 4\ndirect\n0.750001 0.940205 0.190205 Hg\n0.309795 0.250000 0.559795 Hg\n0.559795 0.309795 0.250000 Hg\n0.190206 0.750000 0.940205 Hg\n0.940205 0.190205 0.750000 Hg\n0.250000 0.559795 0.309795 Hg\n0.947195 0.500000 -0.000000 Se\n0.500000 -0.000000 0.947194 Se\n0.552806 0.552806 0.552806 Se\n0.000001 0.947195 0.500000 Se\n0.468501 0.500000 -0.000000 Cl\n0.500000 -0.000000 0.468500 Cl\n0.000000 0.468500 0.500000 Cl\n0.031500 0.031500 0.031500 Cl\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Hg",
"Se",
"Cl"
],
"chemical_system": "Cl-Hg-Se",
"density": 7.119163909767298,
"density_atomic": 0.03613167535247284,
"volume": 387.4716537062499,
"volume_molar": 16.667205993778666,
"formula_full": "Hg6 Se4 Cl4",
"formula_reduced": "Hg3(SeCl)2",
"formula_anonymous": "A2B2C3",
"energy_above_hull": 0.0,
"spacegroup": 199
},
{
"id": "jvasp-56953",
"created_at": "2022-09-04T14:37:29.983219Z",
"updated_at": "2022-09-04T14:37:29.983238Z",
"structure_string": "Rb2 Pd1 I2 Br4\n1.0\n6.829511 0.007271 -2.675316\n-3.652567 6.043290 -1.984185\n0.004394 -0.007271 7.334816\nRb Pd I Br\n2 1 2 4\ndirect\n0.499999 0.250000 0.750000 Rb\n0.499999 0.750000 0.250000 Rb\n0.000000 0.000000 0.000000 Pd\n-0.000000 0.332001 0.332001 I\n-0.000001 0.667999 0.668000 I\n-0.000001 0.787829 0.212172 Br\n0.575656 0.787829 0.787829 Br\n-0.000001 0.212171 0.787829 Br\n0.424343 0.212171 0.212171 Br\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Rb",
"Pd",
"I",
"Br"
],
"chemical_system": "Br-I-Pd-Rb",
"density": 4.66526586658013,
"density_atomic": 0.02972023662761507,
"volume": 302.8239684887803,
"volume_molar": 20.262761819347105,
"formula_full": "Rb2 Pd1 I2 Br4",
"formula_reduced": "Rb2Pd(IBr2)2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-12938",
"created_at": "2022-09-04T14:37:12.297807Z",
"updated_at": "2022-09-04T14:37:12.297842Z",
"structure_string": "Na4 Mg2 Cl8\n1.0\n3.799316 0.000000 0.000000\n0.000000 6.870110 0.000000\n0.000000 -0.000000 11.870316\nNa Mg Cl\n4 2 8\ndirect\n0.500001 0.083375 0.679815 Na\n0.500001 0.916626 0.320186 Na\n0.500001 0.416625 0.179814 Na\n0.500001 0.583375 0.820186 Na\n0.000000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.000000 0.121891 0.195912 Cl\n0.000000 0.878110 0.804088 Cl\n0.000000 0.621891 0.304088 Cl\n0.000000 0.378109 0.695912 Cl\n0.500001 0.238740 0.955618 Cl\n0.500001 0.761260 0.044382 Cl\n0.500001 0.738740 0.544383 Cl\n0.500001 0.261260 0.455618 Cl\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Na",
"Mg",
"Cl"
],
"chemical_system": "Cl-Mg-Na",
"density": 2.273428427138852,
"density_atomic": 0.04518524566968208,
"volume": 309.8356508304562,
"volume_molar": 13.327670726908702,
"formula_full": "Na4 Mg2 Cl8",
"formula_reduced": "Na2MgCl4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.0,
"spacegroup": 55
},
{
"id": "jvasp-41724",
"created_at": "2022-09-04T14:37:32.539649Z",
"updated_at": "2022-09-04T14:37:32.539674Z",
"structure_string": "Ac1 Zn1 Au2\n1.0\n0.000000 3.649681 3.649681\n3.649681 0.000000 3.649681\n3.649681 3.649681 0.000000\nAc Zn Au\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Ac\n0.750000 0.750000 0.750000 Zn\n0.000000 0.000000 0.000000 Au\n0.500000 0.500000 0.500000 Au\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ac",
"Zn",
"Au"
],
"chemical_system": "Ac-Au-Zn",
"density": 11.721819919161188,
"density_atomic": 0.04114009362540701,
"volume": 97.228752963501,
"volume_molar": 14.638130906636755,
"formula_full": "Ac1 Zn1 Au2",
"formula_reduced": "AcZnAu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-57161",
"created_at": "2022-09-04T14:37:33.242599Z",
"updated_at": "2022-09-04T14:37:33.242625Z",
"structure_string": "Li2 Lu2 F8\n1.0\n5.097799 0.115213 -0.000112\n-0.121101 5.100701 -0.000083\n-2.488085 -2.607599 5.235122\nLi Lu F\n2 2 8\ndirect\n0.625274 0.875294 0.750599 Li\n0.374728 0.124705 0.249401 Li\n0.875043 0.625058 0.250106 Lu\n0.124959 0.374942 0.749895 Lu\n0.172952 0.038601 0.412310 F\n0.874215 0.672941 0.912407 F\n0.538192 0.239461 0.912427 F\n0.827050 0.961399 0.587691 F\n0.461810 0.760538 0.087573 F\n0.125786 0.327058 0.087594 F\n0.260630 0.626288 0.587685 F\n0.739371 0.373711 0.412315 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Li",
"Lu",
"F"
],
"chemical_system": "F-Li-Lu",
"density": 6.2888159579998915,
"density_atomic": 0.08810833212260717,
"volume": 136.19597274070966,
"volume_molar": 6.834927656580638,
"formula_full": "Li2 Lu2 F8",
"formula_reduced": "LiLuF4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 88
},
{
"id": "jvasp-11184",
"created_at": "2022-09-04T14:37:07.941276Z",
"updated_at": "2022-09-04T14:37:07.941292Z",
"structure_string": "K4 Rb2 Pd2 F10\n1.0\n7.173541 -0.000000 -0.000000\n0.000000 7.173541 0.000000\n0.000000 0.000000 6.254735\nK Rb Pd F\n4 2 2 10\ndirect\n0.171662 0.328338 0.500000 K\n0.671661 0.171662 0.500000 K\n0.328338 0.828338 0.500000 K\n0.828338 0.671661 0.500000 K\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.000000 Rb\n0.500000 0.000000 0.000000 Pd\n0.000000 0.500000 0.000000 Pd\n0.861975 0.361975 0.222714 F\n0.361975 0.138025 0.222714 F\n0.638025 0.861975 0.222714 F\n0.138025 0.638025 0.222714 F\n0.138025 0.638025 0.777285 F\n0.361975 0.138025 0.777285 F\n0.861975 0.361975 0.777285 F\n0.000000 0.000000 0.500000 F\n0.638025 0.861975 0.777285 F\n0.500000 0.500000 0.500000 F\n",
"nsites": 18,
"nelements": 4,
"elements": [
"K",
"Rb",
"Pd",
"F"
],
"chemical_system": "F-K-Pd-Rb",
"density": 3.7669233876707704,
"density_atomic": 0.055923767457156076,
"volume": 321.86672712617286,
"volume_molar": 10.768481870635128,
"formula_full": "K4 Rb2 Pd2 F10",
"formula_reduced": "K2RbPdF5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 0.0,
"spacegroup": 127
},
{
"id": "jvasp-81470",
"created_at": "2022-09-04T14:37:18.602835Z",
"updated_at": "2022-09-04T14:37:18.602853Z",
"structure_string": "Ba2 Li1 Mg1\n1.0\n-17.025810 -0.000000 -9.829856\n-9.909393 -0.479336 -2.496139\n-8.752440 2.793022 -4.500041\nBa Li Mg\n2 1 1\ndirect\n0.840792 -0.000001 -0.000000 Ba\n0.159209 -0.000000 -0.000000 Ba\n0.000000 0.000000 0.000000 Li\n0.500000 -0.000001 -0.000000 Mg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Li",
"Mg"
],
"chemical_system": "Ba-Li-Mg",
"density": 3.217435608402705,
"density_atomic": 0.025336188462547513,
"volume": 157.8769437207528,
"volume_molar": 23.768929446124286,
"formula_full": "Ba2 Li1 Mg1",
"formula_reduced": "Ba2LiMg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 139
}
]
}