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=310",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=308",
"results": [
{
"id": "jvasp-41378",
"created_at": "2022-09-04T14:37:47.498125Z",
"updated_at": "2022-09-04T14:37:47.498136Z",
"structure_string": "Mg1 Ga1 Ag2\n1.0\n0.000000 3.268036 3.268036\n3.268036 0.000000 3.268036\n3.268036 3.268036 -0.000000\nMg Ga Ag\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Mg\n0.249999 0.249999 0.249999 Ga\n0.500002 0.500002 0.500002 Ag\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Ga",
"Ag"
],
"chemical_system": "Ag-Ga-Mg",
"density": 7.368687017280635,
"density_atomic": 0.057301962975453195,
"volume": 69.80563653139606,
"volume_molar": 10.509484225836632,
"formula_full": "Mg1 Ga1 Ag2",
"formula_reduced": "MgGaAg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-38258",
"created_at": "2022-09-04T14:37:54.244048Z",
"updated_at": "2022-09-04T14:37:54.244074Z",
"structure_string": "Rb3 Ag1\n1.0\n5.915201 0.000000 -0.000000\n0.000000 5.915201 0.000000\n-0.000000 0.000000 5.915201\nRb Ag\n3 1\ndirect\n0.000000 0.500000 0.500000 Rb\n0.500000 0.000000 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"Ag"
],
"chemical_system": "Ag-Rb",
"density": 2.922576519894696,
"density_atomic": 0.01932642258222606,
"volume": 206.97053388859882,
"volume_molar": 31.160142206237307,
"formula_full": "Rb3 Ag1",
"formula_reduced": "Rb3Ag",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-33823",
"created_at": "2022-09-04T14:38:03.095073Z",
"updated_at": "2022-09-04T14:38:03.095098Z",
"structure_string": "Lu2 Cl6\n1.0\n8.964866 0.000000 -0.000000\n-4.482434 7.763803 -0.000000\n-0.000000 0.000000 3.491811\nLu Cl\n2 6\ndirect\n0.666668 0.333334 0.249999 Lu\n0.333334 0.666667 0.750000 Lu\n0.790939 0.209062 0.750000 Cl\n0.418127 0.209062 0.750000 Cl\n0.790939 0.581874 0.750000 Cl\n0.209063 0.790938 0.249999 Cl\n0.581876 0.790938 0.249999 Cl\n0.209064 0.418128 0.249999 Cl\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Lu",
"Cl"
],
"chemical_system": "Cl-Lu",
"density": 3.8443234979764758,
"density_atomic": 0.032917053155116026,
"volume": 243.03512110580976,
"volume_molar": 18.294896361535418,
"formula_full": "Lu2 Cl6",
"formula_reduced": "LuCl3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-36975",
"created_at": "2022-09-04T14:37:55.324240Z",
"updated_at": "2022-09-04T14:37:55.324254Z",
"structure_string": "Ca2 Tl2 F6\n1.0\n5.456933 -0.012077 3.104786\n1.800004 5.151529 3.104786\n-0.017054 -0.012077 6.278338\nCa Tl F\n2 2 6\ndirect\n0.005782 0.005782 0.005782 Ca\n0.505782 0.505781 0.505783 Ca\n0.256238 0.256238 0.256239 Tl\n0.756238 0.756237 0.756240 Tl\n0.255033 0.810591 0.700856 F\n0.810590 0.700854 0.255035 F\n0.700855 0.255032 0.810592 F\n0.200855 0.310590 0.755034 F\n0.755033 0.200854 0.310592 F\n0.310590 0.755033 0.200856 F\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ca",
"Tl",
"F"
],
"chemical_system": "Ca-F-Tl",
"density": 5.6549706613294894,
"density_atomic": 0.05648414985822082,
"volume": 177.04081631928076,
"volume_molar": 10.66164716140014,
"formula_full": "Ca2 Tl2 F6",
"formula_reduced": "CaTlF3",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.0,
"spacegroup": 167
},
{
"id": "jvasp-23542",
"created_at": "2022-09-04T14:37:39.006328Z",
"updated_at": "2022-09-04T14:37:39.006364Z",
"structure_string": "K4 Pb8\n1.0\n3.360094 -5.819855 0.000000\n3.360094 5.819855 0.000000\n0.000000 0.000000 10.886315\nK Pb\n4 8\ndirect\n0.333332 0.666666 0.935403 K\n0.666666 0.333332 0.435403 K\n0.666666 0.333332 0.064597 K\n0.333332 0.666666 0.564598 K\n0.000000 0.000000 0.000000 Pb\n0.000000 0.000000 0.500000 Pb\n0.832509 0.167489 0.750000 Pb\n0.167489 0.334978 0.250000 Pb\n0.665021 0.832509 0.250000 Pb\n0.334978 0.167489 0.750000 Pb\n0.832509 0.665021 0.750000 Pb\n0.167489 0.832509 0.250000 Pb\n",
"nsites": 12,
"nelements": 2,
"elements": [
"K",
"Pb"
],
"chemical_system": "K-Pb",
"density": 7.074736486381061,
"density_atomic": 0.02818426814981532,
"volume": 425.7694376243235,
"volume_molar": 21.367029038997636,
"formula_full": "K4 Pb8",
"formula_reduced": "KPb2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-16483",
"created_at": "2022-09-04T14:37:56.366193Z",
"updated_at": "2022-09-04T14:37:56.366204Z",
"structure_string": "Zr1 Cd3\n1.0\n4.405937 0.000000 0.000000\n0.000000 4.405937 0.000000\n0.000000 0.000000 4.405161\nZr Cd\n1 3\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500000 0.000000 0.500000 Cd\n0.000000 0.500000 0.500000 Cd\n0.500000 0.500000 0.000000 Cd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Zr",
"Cd"
],
"chemical_system": "Cd-Zr",
"density": 8.319897742788593,
"density_atomic": 0.046775844794874545,
"volume": 85.51422251251995,
"volume_molar": 12.874467123808902,
"formula_full": "Zr1 Cd3",
"formula_reduced": "ZrCd3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 221
},
{
"id": "jvasp-35267",
"created_at": "2022-09-04T14:38:03.020727Z",
"updated_at": "2022-09-04T14:38:03.020751Z",
"structure_string": "Na8 Zn4 S8\n1.0\n0.000000 6.853022 0.031372\n7.055452 0.000000 0.000000\n0.000000 -0.529329 -8.799031\nNa Zn S\n8 4 8\ndirect\n0.546607 0.674967 0.678225 Na\n0.953392 0.174967 0.321775 Na\n0.453392 0.325033 0.321775 Na\n0.046607 0.825033 0.678225 Na\n0.512219 0.764262 0.052873 Na\n0.987781 0.264263 0.947127 Na\n0.487781 0.235737 0.947127 Na\n0.012219 0.735737 0.052873 Na\n0.344237 0.903463 0.370420 Zn\n0.155762 0.403463 0.629580 Zn\n0.655762 0.096536 0.629580 Zn\n0.844237 0.596536 0.370420 Zn\n0.302624 0.106654 0.591571 S\n0.197375 0.606654 0.408429 S\n0.697375 0.893346 0.408430 S\n0.802624 0.393346 0.591571 S\n0.246252 0.044452 0.143656 S\n0.253748 0.544452 0.856344 S\n0.753748 0.955547 0.856344 S\n0.746252 0.455547 0.143657 S\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Na",
"Zn",
"S"
],
"chemical_system": "Na-S-Zn",
"density": 2.74100536206762,
"density_atomic": 0.047022725506421684,
"volume": 425.3262605390385,
"volume_molar": 12.806873049452618,
"formula_full": "Na8 Zn4 S8",
"formula_reduced": "Na2ZnS2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.0,
"spacegroup": 14
},
{
"id": "jvasp-25015",
"created_at": "2022-09-04T14:37:46.713828Z",
"updated_at": "2022-09-04T14:37:46.713846Z",
"structure_string": "K4 Sn1 Sb2 F14\n1.0\n6.714871 -0.004058 -0.019419\n-3.202407 6.730780 -0.022452\n-0.210850 -0.473142 7.588216\nK Sn Sb F\n4 1 2 14\ndirect\n0.282538 0.553201 0.145083 K\n0.851913 0.730206 0.413268 K\n0.717461 0.446799 0.854918 K\n0.148087 0.269794 0.586733 K\n0.000000 0.000000 0.000000 Sn\n0.402764 0.817168 0.688530 Sb\n0.597235 0.182832 0.311470 Sb\n0.594710 0.426306 0.181543 F\n0.405290 0.573695 0.818457 F\n0.154751 0.142404 0.229612 F\n0.080186 0.626961 0.672128 F\n0.845248 0.857596 0.770389 F\n0.052630 0.764432 0.063378 F\n0.714551 0.886792 0.122511 F\n0.947370 0.235568 0.936623 F\n0.721362 0.057083 0.509819 F\n0.429082 0.657517 0.480987 F\n0.285449 0.113208 0.877490 F\n0.919813 0.373039 0.327873 F\n0.278638 0.942917 0.490182 F\n0.570918 0.342483 0.519014 F\n",
"nsites": 21,
"nelements": 4,
"elements": [
"K",
"Sn",
"Sb",
"F"
],
"chemical_system": "F-K-Sb-Sn",
"density": 3.801391456598713,
"density_atomic": 0.061272277043514456,
"volume": 342.73248870914625,
"volume_molar": 9.828491857293283,
"formula_full": "K4 Sn1 Sb2 F14",
"formula_reduced": "K4SnSb2F14",
"formula_anonymous": "AB2C4D14",
"energy_above_hull": 0.0,
"spacegroup": 2
},
{
"id": "jvasp-109006",
"created_at": "2022-09-04T14:37:46.718544Z",
"updated_at": "2022-09-04T14:37:46.718553Z",
"structure_string": "Rb3 Tl1 I6\n1.0\n7.775444 0.000000 4.489155\n2.591815 7.330759 4.489155\n-0.000000 0.000000 8.978310\nRb Tl I\n3 1 6\ndirect\n0.749999 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.499999 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Tl\n0.764523 0.235476 0.235476 I\n0.235476 0.235476 0.764524 I\n0.235476 0.764524 0.764523 I\n0.235476 0.764524 0.235476 I\n0.764523 0.235476 0.764523 I\n0.764523 0.764524 0.235476 I\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Rb",
"Tl",
"I"
],
"chemical_system": "I-Rb-Tl",
"density": 3.965769281204197,
"density_atomic": 0.019540301633505865,
"volume": 511.7628267750455,
"volume_molar": 30.819077785748206,
"formula_full": "Rb3 Tl1 I6",
"formula_reduced": "Rb3TlI6",
"formula_anonymous": "AB3C6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-108644",
"created_at": "2022-09-04T14:37:55.354109Z",
"updated_at": "2022-09-04T14:37:55.354128Z",
"structure_string": "Li1 Pr1 Zn2\n1.0\n4.253662 -0.000000 2.455853\n1.417887 4.010391 2.455853\n-0.000000 -0.000000 4.911706\nLi Pr Zn\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Pr\n0.750000 0.750000 0.750000 Zn\n0.250000 0.250000 0.250000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Pr",
"Zn"
],
"chemical_system": "Li-Pr-Zn",
"density": 5.522707425905193,
"density_atomic": 0.04773950741015012,
"volume": 83.78804510139418,
"volume_molar": 12.614585040145604,
"formula_full": "Li1 Pr1 Zn2",
"formula_reduced": "LiPrZn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-40267",
"created_at": "2022-09-04T14:37:49.030485Z",
"updated_at": "2022-09-04T14:37:49.030504Z",
"structure_string": "Sm1 Cd1 Hg2\n1.0\n-0.000000 3.627838 3.627838\n3.627838 -0.000000 3.627838\n3.627838 3.627838 -0.000000\nSm Cd Hg\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Sm\n0.249999 0.249999 0.249999 Cd\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sm",
"Cd",
"Hg"
],
"chemical_system": "Cd-Hg-Sm",
"density": 11.545466209327985,
"density_atomic": 0.04188768308289273,
"volume": 95.49346503802289,
"volume_molar": 14.376877202977814,
"formula_full": "Sm1 Cd1 Hg2",
"formula_reduced": "SmCdHg2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-38838",
"created_at": "2022-09-04T14:37:55.375253Z",
"updated_at": "2022-09-04T14:37:55.375272Z",
"structure_string": "Ca2 Cd1 In1\n1.0\n-0.000000 3.814110 3.814122\n3.814106 0.000004 3.814118\n3.814107 3.814107 0.000003\nCa Cd In\n2 1 1\ndirect\n0.499999 0.500000 0.500000 Ca\n-0.000000 -0.000000 -0.000000 Ca\n0.249999 0.250000 0.249998 Cd\n0.749999 0.750000 0.750002 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Cd",
"In"
],
"chemical_system": "Ca-Cd-In",
"density": 4.599620061100202,
"density_atomic": 0.03604542766893322,
"volume": 110.97107896010662,
"volume_molar": 16.707086444670914,
"formula_full": "Ca2 Cd1 In1",
"formula_reduced": "Ca2CdIn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}