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=-chemical_system&page=581",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=579",
"results": [
{
"id": "jvasp-100212",
"created_at": "2022-09-04T14:36:19.683395Z",
"updated_at": "2022-09-04T14:36:19.683422Z",
"structure_string": "Na3 Si1\n1.0\n4.467222 -0.000000 2.579153\n1.489074 4.211738 2.579153\n-0.000000 -0.000000 5.158304\nNa Si\n3 1\ndirect\n0.250000 0.250000 0.250000 Na\n0.749999 0.750000 0.749999 Na\n0.499999 0.500000 0.499999 Na\n0.000000 0.000000 0.000000 Si\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"Si"
],
"chemical_system": "Na-Si",
"density": 1.6605820367438882,
"density_atomic": 0.04121489288296164,
"volume": 97.05229639584026,
"volume_molar": 14.611564749424769,
"formula_full": "Na3 Si1",
"formula_reduced": "Na3Si",
"formula_anonymous": "AB3",
"energy_above_hull": 0.2752913999999999,
"spacegroup": 225
},
{
"id": "jvasp-10101",
"created_at": "2022-09-04T14:37:50.485624Z",
"updated_at": "2022-09-04T14:37:50.485645Z",
"structure_string": "Na4 Zr2 Se6\n1.0\n6.584264 -0.000000 2.238597\n3.292132 6.031461 1.119299\n0.013231 -0.000000 7.236977\nNa Zr Se\n4 2 6\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.000000 0.500001 Na\n0.157470 0.685058 0.500001 Na\n0.842529 0.314942 0.500001 Na\n0.668667 0.662664 0.000001 Zr\n0.331332 0.337336 0.000000 Zr\n0.434796 0.641516 0.773290 Se\n0.282440 0.000000 0.224639 Se\n0.565203 0.358484 0.226712 Se\n0.923686 0.641516 0.226712 Se\n0.076313 0.358484 0.773289 Se\n0.717559 0.000000 0.775363 Se\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Na",
"Zr",
"Se"
],
"chemical_system": "Na-Se-Zr",
"density": 4.325444815928597,
"density_atomic": 0.041779605123081015,
"volume": 287.22147958671434,
"volume_molar": 14.414068161388837,
"formula_full": "Na4 Zr2 Se6",
"formula_reduced": "Na2ZrSe3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.0754671000000005,
"spacegroup": 12
},
{
"id": "jvasp-35264",
"created_at": "2022-09-04T14:38:05.084123Z",
"updated_at": "2022-09-04T14:38:05.084136Z",
"structure_string": "Na8 Zn4 Se8\n1.0\n0.000000 7.172996 0.014435\n7.373204 0.000000 0.000000\n0.000000 -0.483773 -9.114575\nNa Zn Se\n8 4 8\ndirect\n0.539996 0.684064 0.676740 Na\n0.960005 0.184065 0.323261 Na\n0.460005 0.315935 0.323261 Na\n0.039996 0.815935 0.676740 Na\n0.512210 0.765013 0.058480 Na\n0.987792 0.265013 0.941522 Na\n0.487792 0.234986 0.941521 Na\n0.012209 0.734986 0.058480 Na\n0.342341 0.906792 0.371674 Zn\n0.157660 0.406793 0.628327 Zn\n0.657660 0.093207 0.628327 Zn\n0.842341 0.593207 0.371674 Zn\n0.299886 0.101732 0.599235 Se\n0.200114 0.601731 0.400766 Se\n0.700115 0.898268 0.400766 Se\n0.799887 0.398268 0.599235 Se\n0.244544 0.046500 0.140631 Se\n0.255457 0.546499 0.859370 Se\n0.755458 0.953500 0.859370 Se\n0.744544 0.453500 0.140631 Se\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Na",
"Zn",
"Se"
],
"chemical_system": "Na-Se-Zn",
"density": 3.7111827497804484,
"density_atomic": 0.04149379190219381,
"volume": 481.9998145058077,
"volume_molar": 14.51335364623932,
"formula_full": "Na8 Zn4 Se8",
"formula_reduced": "Na2ZnSe2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.017898269333333,
"spacegroup": 14
},
{
"id": "jvasp-35260",
"created_at": "2022-09-04T14:37:56.260552Z",
"updated_at": "2022-09-04T14:37:56.260578Z",
"structure_string": "Na12 Zn2 Se8\n1.0\n4.659978 -8.071319 -0.000000\n4.659978 8.071319 0.000000\n0.000000 -0.000000 7.151166\nNa Zn Se\n12 2 8\ndirect\n0.296769 0.148385 0.039452 Na\n0.528546 0.057092 0.365772 Na\n0.942908 0.471454 0.365772 Na\n0.471454 0.942908 0.865772 Na\n0.471454 0.528546 0.865772 Na\n0.057092 0.528546 0.865772 Na\n0.528546 0.471454 0.365772 Na\n0.148385 0.851616 0.539453 Na\n0.703231 0.851616 0.539453 Na\n0.851616 0.703231 0.039452 Na\n0.851616 0.148385 0.039452 Na\n0.148385 0.296769 0.539453 Na\n0.666667 0.333333 0.747821 Zn\n0.333333 0.666667 0.247821 Zn\n0.186215 0.813785 0.139049 Se\n0.666667 0.333333 0.098849 Se\n0.333333 0.666667 0.598849 Se\n0.372430 0.186215 0.639049 Se\n0.813785 0.186215 0.639049 Se\n0.813785 0.627570 0.639049 Se\n0.627570 0.813785 0.139049 Se\n0.186215 0.372430 0.139049 Se\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Na",
"Zn",
"Se"
],
"chemical_system": "Na-Se-Zn",
"density": 3.205296313993981,
"density_atomic": 0.04089662292492663,
"volume": 537.941727863083,
"volume_molar": 14.725276390314091,
"formula_full": "Na12 Zn2 Se8",
"formula_reduced": "Na6ZnSe4",
"formula_anonymous": "AB4C6",
"energy_above_hull": 0.0,
"spacegroup": 186
},
{
"id": "jvasp-35214",
"created_at": "2022-09-04T14:38:00.845741Z",
"updated_at": "2022-09-04T14:38:00.845771Z",
"structure_string": "Na4 Zn2 Se4\n1.0\n5.576677 -0.000000 -2.578332\n-1.393230 5.756199 -3.013422\n0.031104 0.039382 7.387342\nNa Zn Se\n4 2 4\ndirect\n0.138354 0.479929 0.276708 Na\n0.861645 0.520070 0.723292 Na\n0.361645 0.203221 0.723292 Na\n0.638355 0.796779 0.276708 Na\n0.250000 -0.000000 0.000000 Zn\n0.750000 -0.000000 0.000000 Zn\n0.615972 0.333377 0.231945 Se\n0.384028 0.666623 0.768055 Se\n0.884029 0.101432 0.768055 Se\n0.115971 0.898568 0.231945 Se\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Na",
"Zn",
"Se"
],
"chemical_system": "Na-Se-Zn",
"density": 3.7516241371820525,
"density_atomic": 0.04194595678498688,
"volume": 238.4020002514082,
"volume_molar": 14.356904029795357,
"formula_full": "Na4 Zn2 Se4",
"formula_reduced": "Na2ZnSe2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.018372269333333,
"spacegroup": 72
},
{
"id": "jvasp-35263",
"created_at": "2022-09-04T14:38:06.797823Z",
"updated_at": "2022-09-04T14:38:06.797852Z",
"structure_string": "Na8 Zn8 Se12\n1.0\n7.341324 -0.000000 -0.000000\n-0.000000 7.341324 -0.000000\n-0.000000 -0.000000 12.082831\nNa Zn Se\n8 8 12\ndirect\n0.940684 0.344648 0.445614 Na\n0.059316 0.655352 0.945614 Na\n0.844647 0.559315 0.695614 Na\n0.155352 0.440684 0.195614 Na\n0.655352 0.059316 0.054386 Na\n0.344648 0.940684 0.554386 Na\n0.559315 0.844647 0.304386 Na\n0.440684 0.155352 0.804386 Na\n0.690247 0.523095 0.115789 Zn\n0.309752 0.476905 0.615789 Zn\n0.023095 0.809752 0.365789 Zn\n0.976904 0.190247 0.865789 Zn\n0.476905 0.309752 0.384211 Zn\n0.809752 0.023095 0.634211 Zn\n0.190247 0.976904 0.134211 Zn\n0.523095 0.690247 0.884211 Zn\n0.781844 0.781844 0.500000 Se\n0.585296 0.277939 0.580528 Se\n0.414703 0.722060 0.080528 Se\n0.777939 0.914703 0.830528 Se\n0.222060 0.085296 0.330528 Se\n0.722060 0.414703 0.919472 Se\n0.277939 0.585296 0.419472 Se\n0.914703 0.777939 0.169472 Se\n0.085296 0.222060 0.669472 Se\n0.718155 0.281844 0.250000 Se\n0.281844 0.718155 0.750000 Se\n0.218155 0.218155 0.000000 Se\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Na",
"Zn",
"Se"
],
"chemical_system": "Na-Se-Zn",
"density": 4.2194276573730995,
"density_atomic": 0.04299723684200821,
"volume": 651.2046367743347,
"volume_molar": 14.005878522213273,
"formula_full": "Na8 Zn8 Se12",
"formula_reduced": "Na2Zn2Se3",
"formula_anonymous": "A2B2C3",
"energy_above_hull": 0.1761819095238096,
"spacegroup": 96
},
{
"id": "jvasp-35262",
"created_at": "2022-09-04T14:37:56.414177Z",
"updated_at": "2022-09-04T14:37:56.414209Z",
"structure_string": "Na4 Zn6 Se8\n1.0\n2.879108 -5.537092 -0.000000\n5.923907 -0.436827 6.770859\n-3.044802 -5.100263 6.770859\nNa Zn Se\n4 6 8\ndirect\n0.741121 0.623369 0.376631 Na\n0.258879 0.376632 0.623368 Na\n0.758879 0.123369 0.876631 Na\n0.241121 0.876632 0.123368 Na\n0.750000 0.461272 0.038728 Zn\n0.250000 0.538729 0.961271 Zn\n0.750000 0.038729 0.461271 Zn\n0.250000 0.250000 0.250000 Zn\n0.750000 0.750001 0.750000 Zn\n0.250000 0.961272 0.538728 Zn\n0.094599 0.766326 0.506116 Se\n0.594598 0.006116 0.266325 Se\n0.132960 0.266325 0.006116 Se\n0.905402 0.233675 0.493883 Se\n0.367040 0.493884 0.233675 Se\n0.405402 0.993884 0.733675 Se\n0.867040 0.733676 0.993883 Se\n0.632960 0.506117 0.766325 Se\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Na",
"Zn",
"Se"
],
"chemical_system": "Na-Se-Zn",
"density": 4.338755316122247,
"density_atomic": 0.042139381030845684,
"volume": 427.15387743413095,
"volume_molar": 14.29100431160069,
"formula_full": "Na4 Zn6 Se8",
"formula_reduced": "Na2Zn3Se4",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 0.1189785703703705,
"spacegroup": 72
},
{
"id": "jvasp-120349",
"created_at": "2022-09-04T14:38:48.236160Z",
"updated_at": "2022-09-04T14:38:48.236188Z",
"structure_string": "Na2 Zn2 Se2\n1.0\n4.897806 0.000000 0.000000\n-0.000000 4.897806 0.000000\n0.000000 0.000000 6.082682\nNa Zn Se\n2 2 2\ndirect\n0.000000 0.500000 0.169966 Na\n0.500000 0.000000 0.830033 Na\n0.500000 0.500000 0.500000 Zn\n0.000000 0.000000 0.500000 Zn\n0.000000 0.500000 0.695163 Se\n0.500000 0.000000 0.304836 Se\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Na",
"Zn",
"Se"
],
"chemical_system": "Na-Se-Zn",
"density": 3.8091607132241134,
"density_atomic": 0.04111998809344663,
"volume": 145.91443913759866,
"volume_molar": 14.645288190051204,
"formula_full": "Na2 Zn2 Se2",
"formula_reduced": "NaZnSe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0,
"spacegroup": 129
},
{
"id": "jvasp-120353",
"created_at": "2022-09-04T14:38:48.302278Z",
"updated_at": "2022-09-04T14:38:48.302304Z",
"structure_string": "Na1 Zn1 Se2\n1.0\n3.864458 0.000000 -0.000000\n-1.932229 3.346719 0.000000\n-0.000000 -0.000000 7.449287\nNa Zn Se\n1 1 2\ndirect\n0.000000 0.000000 0.240950 Na\n0.333334 0.666667 0.661043 Zn\n0.333334 0.666667 0.982850 Se\n0.666667 0.333334 0.514259 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Zn",
"Se"
],
"chemical_system": "Na-Se-Zn",
"density": 4.2454531804730475,
"density_atomic": 0.04151809742532616,
"volume": 96.34352843827541,
"volume_molar": 14.50485723925894,
"formula_full": "Na1 Zn1 Se2",
"formula_reduced": "NaZnSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2793333416666667,
"spacegroup": 156
},
{
"id": "jvasp-120352",
"created_at": "2022-09-04T14:38:51.667672Z",
"updated_at": "2022-09-04T14:38:51.667682Z",
"structure_string": "Na1 Zn1 Se1\n1.0\n5.771364 0.996334 0.000000\n-2.083461 3.554010 0.000000\n0.000000 0.000000 4.156579\nNa Zn Se\n1 1 1\ndirect\n0.325960 -0.003689 0.000000 Na\n0.718670 0.692718 0.000000 Zn\n0.955368 0.310970 0.000000 Se\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"Zn",
"Se"
],
"chemical_system": "Na-Se-Zn",
"density": 2.9600363898211532,
"density_atomic": 0.03195366913321762,
"volume": 93.88593176867231,
"volume_molar": 18.846476549823343,
"formula_full": "Na1 Zn1 Se1",
"formula_reduced": "NaZnSe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.07173,
"spacegroup": 38
},
{
"id": "jvasp-120351",
"created_at": "2022-09-04T14:38:51.636045Z",
"updated_at": "2022-09-04T14:38:51.636074Z",
"structure_string": "Na1 Zn1 Se2\n1.0\n1.862487 1.075308 7.235890\n-1.862487 1.075308 7.235890\n0.000000 -2.150615 7.235890\nNa Zn Se\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Zn\n0.737586 0.737586 0.737586 Se\n0.262414 0.262414 0.262414 Se\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Zn",
"Se"
],
"chemical_system": "Na-Se-Zn",
"density": 4.704109306742693,
"density_atomic": 0.04600349131042938,
"volume": 86.94992240932737,
"volume_molar": 13.090616795501195,
"formula_full": "Na1 Zn1 Se2",
"formula_reduced": "NaZnSe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2877758416666666,
"spacegroup": 166
},
{
"id": "jvasp-120350",
"created_at": "2022-09-04T14:38:48.241356Z",
"updated_at": "2022-09-04T14:38:48.241381Z",
"structure_string": "Na1 Zn1 Se1\n1.0\n3.046255 0.000000 0.000000\n-0.000000 3.046255 -0.000000\n0.000000 0.000000 8.003422\nNa Zn Se\n1 1 1\ndirect\n0.000000 0.000000 -0.099065 Na\n0.000000 0.000000 0.551224 Zn\n0.000000 0.000000 0.241645 Se\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Na",
"Zn",
"Se"
],
"chemical_system": "Na-Se-Zn",
"density": 3.7418755917176534,
"density_atomic": 0.04039364347227943,
"volume": 74.26911122931463,
"volume_molar": 14.908634731434312,
"formula_full": "Na1 Zn1 Se1",
"formula_reduced": "NaZnSe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.15286,
"spacegroup": 99
}
]
}