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=-updated_at&page=335",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=333",
"results": [
{
"id": "jvasp-118567",
"created_at": "2022-09-04T14:38:45.550376Z",
"updated_at": "2022-09-04T14:38:45.550410Z",
"structure_string": "Rb1 I1 N1\n1.0\n3.992417 0.000000 0.000000\n0.000000 3.992417 0.000000\n0.000000 0.000000 7.833390\nRb I N\n1 1 1\ndirect\n0.000000 0.000000 0.690757 Rb\n0.000000 0.000000 0.256216 I\n0.000000 0.000000 0.008980 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Rb",
"I",
"N"
],
"chemical_system": "I-N-Rb",
"density": 3.0106733304506097,
"density_atomic": 0.02402700911389934,
"volume": 124.85948566376227,
"volume_molar": 25.064046596279283,
"formula_full": "Rb1 I1 N1",
"formula_reduced": "RbIN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4666898416666665,
"spacegroup": 99
},
{
"id": "jvasp-115270",
"created_at": "2022-09-04T14:38:45.550164Z",
"updated_at": "2022-09-04T14:38:45.550209Z",
"structure_string": "Sr1 As1 Au1\n1.0\n3.100590 0.000000 -0.000000\n0.000000 3.100590 -0.000000\n0.000000 -0.000000 8.555881\nSr As Au\n1 1 1\ndirect\n0.000000 0.000000 0.007412 Sr\n0.000000 0.000000 0.356360 As\n0.000000 0.000000 0.658759 Au\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Sr",
"As",
"Au"
],
"chemical_system": "As-Au-Sr",
"density": 7.257790720228756,
"density_atomic": 0.0364726933414498,
"volume": 82.25331680100017,
"volume_molar": 16.511368391749862,
"formula_full": "Sr1 As1 Au1",
"formula_reduced": "SrAsAu",
"formula_anonymous": "ABC",
"energy_above_hull": 0.7740752100000001,
"spacegroup": 99
},
{
"id": "jvasp-112146",
"created_at": "2022-09-04T14:38:45.547539Z",
"updated_at": "2022-09-04T14:38:45.547569Z",
"structure_string": "Zr1 H2 C3 O4\n1.0\n3.917128 -0.047756 0.377727\n1.479763 3.999320 0.277078\n-0.061872 0.066817 6.076751\nZr H C O\n1 2 3 4\ndirect\n0.163989 0.327613 0.506680 Zr\n0.201450 0.736458 0.948171 H\n0.509943 0.961301 0.944881 H\n0.629286 0.605135 0.694805 C\n0.488457 0.715431 0.930755 C\n0.657863 0.506434 0.128132 C\n0.333279 0.801092 0.555649 O\n0.660620 0.268244 0.663615 O\n0.558217 0.265121 0.210602 O\n0.892588 0.586780 0.222405 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Zr",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Zr",
"density": 3.354008756396465,
"density_atomic": 0.10450849455083501,
"volume": 95.6860018219457,
"volume_molar": 5.762345717333734,
"formula_full": "Zr1 H2 C3 O4",
"formula_reduced": "ZrH2C3O4",
"formula_anonymous": "AB2C3D4",
"energy_above_hull": 4.339081850000001,
"spacegroup": 1
},
{
"id": "jvasp-115630",
"created_at": "2022-09-04T14:38:45.538824Z",
"updated_at": "2022-09-04T14:38:45.538837Z",
"structure_string": "Ca1 Be1 Rh1\n1.0\n2.773669 -0.000000 -0.000000\n0.000000 2.773669 0.000000\n0.000000 0.000000 7.463548\nCa Be Rh\n1 1 1\ndirect\n0.000000 0.000000 0.674665 Ca\n0.000000 0.000000 0.296322 Be\n0.000000 0.000000 0.019234 Rh\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"Be",
"Rh"
],
"chemical_system": "Be-Ca-Rh",
"density": 4.395676796928273,
"density_atomic": 0.0522476376974629,
"volume": 57.41886393737716,
"volume_molar": 11.526149363672435,
"formula_full": "Ca1 Be1 Rh1",
"formula_reduced": "CaBeRh",
"formula_anonymous": "ABC",
"energy_above_hull": 1.5560731733333335,
"spacegroup": 99
},
{
"id": "jvasp-104495",
"created_at": "2022-09-04T14:38:45.536211Z",
"updated_at": "2022-09-04T14:38:45.536235Z",
"structure_string": "Na2 Y1 Cu1 F6\n1.0\n5.279453 -0.000000 3.048094\n1.759818 4.977516 3.048094\n-0.000000 -0.000000 6.096188\nNa Y Cu F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Na\n0.750000 0.750001 0.749999 Na\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.499999 Cu\n0.249168 0.249169 0.750831 F\n0.249168 0.750832 0.750831 F\n0.750831 0.750832 0.249168 F\n0.249168 0.750832 0.249168 F\n0.750831 0.249169 0.750831 F\n0.750831 0.249169 0.249168 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Na",
"Y",
"Cu",
"F"
],
"chemical_system": "Cu-F-Na-Y",
"density": 3.238400024319482,
"density_atomic": 0.062422341545889194,
"volume": 160.1990529728622,
"volume_molar": 9.647412466212728,
"formula_full": "Na2 Y1 Cu1 F6",
"formula_reduced": "Na2YCuF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-115263",
"created_at": "2022-09-04T14:38:45.536115Z",
"updated_at": "2022-09-04T14:38:45.536138Z",
"structure_string": "Na1 Rh1 O2\n1.0\n1.572528 0.907899 5.100056\n-1.572528 0.907899 5.100056\n0.000000 -1.815799 5.100056\nNa Rh O\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 Rh\n0.233781 0.233781 0.233781 O\n0.766220 0.766220 0.766220 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Rh",
"O"
],
"chemical_system": "Na-O-Rh",
"density": 6.0014008518415345,
"density_atomic": 0.09155829820402557,
"volume": 43.68801166538208,
"volume_molar": 6.577383894336322,
"formula_full": "Na1 Rh1 O2",
"formula_reduced": "NaRhO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4130272499999998,
"spacegroup": 166
},
{
"id": "jvasp-117121",
"created_at": "2022-09-04T14:38:45.535462Z",
"updated_at": "2022-09-04T14:38:45.535485Z",
"structure_string": "Li4 H8 N4\n1.0\n3.840214 -0.000000 0.000000\n0.000000 5.243264 0.000000\n-0.000000 -0.000000 6.760284\nLi H N\n4 8 4\ndirect\n0.179968 0.665337 0.584847 Li\n0.679968 0.834662 0.415153 Li\n0.320031 0.334663 0.084847 Li\n0.820031 0.165337 0.915153 Li\n0.674090 0.542754 0.761862 H\n0.174090 -0.042754 0.238137 H\n-0.174090 0.457245 0.261863 H\n0.325909 0.042754 0.738137 H\n0.656585 0.348371 0.574684 H\n0.156586 0.151629 0.425315 H\n0.843413 0.651629 0.074685 H\n0.343414 0.848370 0.925315 H\n0.183671 0.962036 0.390219 N\n0.683670 0.537963 0.609781 N\n0.316329 0.037963 0.890218 N\n0.816328 0.462036 0.109781 N\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Li",
"H",
"N"
],
"chemical_system": "H-Li-N",
"density": 1.120538005400548,
"density_atomic": 0.1175433028784487,
"volume": 136.1200477456854,
"volume_molar": 5.123338048640239,
"formula_full": "Li4 H8 N4",
"formula_reduced": "LiH2N",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.6139833124999994,
"spacegroup": 19
},
{
"id": "jvasp-113649",
"created_at": "2022-09-04T14:38:45.530436Z",
"updated_at": "2022-09-04T14:38:45.530463Z",
"structure_string": "Al1 H2 O2\n1.0\n2.911883 0.000000 -0.000000\n-1.455942 2.521765 0.000000\n-0.000000 -0.000000 5.721107\nAl H O\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.666665 0.333333 0.357368 H\n0.333332 0.666666 0.642632 H\n0.333332 0.666666 0.835522 O\n0.666665 0.333333 0.164479 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Al",
"H",
"O"
],
"chemical_system": "Al-H-O",
"density": 2.410978877755766,
"density_atomic": 0.1190176580573275,
"volume": 42.01057289828068,
"volume_molar": 5.0598716680337485,
"formula_full": "Al1 H2 O2",
"formula_reduced": "Al(HO)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.19427796,
"spacegroup": 164
},
{
"id": "jvasp-118566",
"created_at": "2022-09-04T14:38:45.529925Z",
"updated_at": "2022-09-04T14:38:45.529956Z",
"structure_string": "Rb1 I1 N1\n1.0\n5.893023 0.000000 -0.000000\n-2.946511 5.103507 0.000000\n-0.000000 0.000000 4.581868\nRb I N\n1 1 1\ndirect\n0.666666 0.333333 0.000000 Rb\n0.000000 0.000000 0.000000 I\n0.333333 0.666666 0.000000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Rb",
"I",
"N"
],
"chemical_system": "I-N-Rb",
"density": 2.7279458972607142,
"density_atomic": 0.02177067178719699,
"volume": 137.80006558016532,
"volume_molar": 27.661713055366224,
"formula_full": "Rb1 I1 N1",
"formula_reduced": "RbIN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4238931749999997,
"spacegroup": 187
},
{
"id": "jvasp-115240",
"created_at": "2022-09-04T14:38:45.527418Z",
"updated_at": "2022-09-04T14:38:45.527432Z",
"structure_string": "Ti1 Mn1 O4\n1.0\n-1.877932 1.877932 4.699906\n1.877932 -1.877932 4.699906\n1.877932 1.877932 -4.699906\nTi Mn O\n1 1 4\ndirect\n0.749999 0.250000 0.499999 Ti\n0.000000 0.000000 0.000000 Mn\n0.962156 0.462158 0.499999 O\n0.798460 0.798460 0.000000 O\n0.537841 0.037842 0.499999 O\n0.201540 0.201540 0.000000 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ti",
"Mn",
"O"
],
"chemical_system": "Mn-O-Ti",
"density": 4.1777566808459365,
"density_atomic": 0.09049870450835733,
"volume": 66.29929160417888,
"volume_molar": 6.654394438810857,
"formula_full": "Ti1 Mn1 O4",
"formula_reduced": "TiMnO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.859351595785441,
"spacegroup": 119
},
{
"id": "jvasp-110845",
"created_at": "2022-09-04T14:38:45.520654Z",
"updated_at": "2022-09-04T14:38:45.520676Z",
"structure_string": "Pm2 Ni1 Ge1\n1.0\n4.367901 -0.000000 2.521809\n1.455967 4.118097 2.521809\n-0.000000 -0.000000 5.043618\nPm Ni Ge\n2 1 1\ndirect\n0.750000 0.750001 0.750000 Pm\n0.250000 0.250000 0.250000 Pm\n0.000000 0.000000 0.000000 Ni\n0.500000 0.500000 0.500000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Ni",
"Ge"
],
"chemical_system": "Ge-Ni-Pm",
"density": 7.711936430504947,
"density_atomic": 0.04409084751669081,
"volume": 90.72177618009678,
"volume_molar": 13.658482653843949,
"formula_full": "Pm2 Ni1 Ge1",
"formula_reduced": "Pm2NiGe",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.1193876749999998,
"spacegroup": 225
},
{
"id": "jvasp-116771",
"created_at": "2022-09-04T14:38:45.520195Z",
"updated_at": "2022-09-04T14:38:45.520222Z",
"structure_string": "La2 Mn2 Zn2 Fe2 O12\n1.0\n5.473068 0.000096 -0.000035\n0.000105 5.272940 -0.006828\n-0.000016 0.013985 7.536287\nLa Mn Zn Fe O\n2 2 2 2 12\ndirect\n0.005267 0.991840 0.250022 La\n0.494698 0.492165 0.750022 La\n0.500673 0.000578 0.499889 Mn\n0.999326 0.500503 -0.000109 Mn\n0.503620 0.529284 0.250268 Zn\n0.996382 0.029305 0.750277 Zn\n0.500992 0.000678 0.000433 Fe\n0.999003 0.500569 0.500425 Fe\n0.732278 0.735642 0.444203 O\n0.767680 0.235720 0.944184 O\n0.763259 0.228242 0.555413 O\n0.503004 0.927673 0.745253 O\n0.498102 0.139894 0.254982 O\n0.224048 0.226808 0.944377 O\n0.271168 0.719301 0.055131 O\n0.228865 0.219365 0.555144 O\n0.736758 0.728218 0.055410 O\n0.001901 0.639915 0.754987 O\n0.275916 0.726810 0.444441 O\n0.997052 0.427505 0.245252 O\n",
"nsites": 20,
"nelements": 5,
"elements": [
"La",
"Mn",
"Zn",
"Fe",
"O"
],
"chemical_system": "Fe-La-Mn-O-Zn",
"density": 6.27737387149051,
"density_atomic": 0.09195764688058199,
"volume": 217.49142870056684,
"volume_molar": 6.548819988641587,
"formula_full": "La2 Mn2 Zn2 Fe2 O12",
"formula_reduced": "LaMnZnFeO6",
"formula_anonymous": "ABCDE6",
"energy_above_hull": 2.474827914137931,
"spacegroup": 7
}
]
}