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=571",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=569",
"results": [
{
"id": "jvasp-86206",
"created_at": "2022-09-04T14:35:54.987785Z",
"updated_at": "2022-09-04T14:35:54.987810Z",
"structure_string": "H6 Au2 C4 N2 Cl2\n1.0\n4.030959 0.000000 -0.233969\n0.000000 6.188351 0.000000\n0.009198 0.000000 9.061895\nH Au C N Cl\n6 2 4 2 2\ndirect\n0.718098 0.560570 0.126506 H\n0.363801 0.707011 0.049794 H\n0.280992 0.352451 0.873413 H\n0.281903 0.060570 0.873493 H\n0.636200 0.207011 0.950205 H\n0.719008 0.852451 0.126586 H\n0.139026 0.706879 0.584781 Au\n0.860975 0.206879 0.415219 Au\n0.677050 0.206871 0.606073 C\n0.322951 0.706870 0.393927 C\n0.434568 0.206707 0.863198 C\n0.565433 0.706707 0.136801 C\n0.430085 0.706815 0.277345 N\n0.569916 0.206815 0.722654 N\n0.079070 0.206788 0.187080 Cl\n0.920930 0.706788 0.812919 Cl\n",
"nsites": 16,
"nelements": 5,
"elements": [
"H",
"Au",
"C",
"N",
"Cl"
],
"chemical_system": "Au-C-Cl-H-N",
"density": 4.017567827497582,
"density_atomic": 0.07077698393165625,
"volume": 226.0621901528036,
"volume_molar": 8.508614560087931,
"formula_full": "H6 Au2 C4 N2 Cl2",
"formula_reduced": "H3AuC2NCl",
"formula_anonymous": "ABCD2E3",
"energy_above_hull": 3.7018793609375,
"spacegroup": 11
},
{
"id": "jvasp-62513",
"created_at": "2022-09-04T14:35:48.193379Z",
"updated_at": "2022-09-04T14:35:48.193414Z",
"structure_string": "H6 Au2 C4 N2 Cl2\n1.0\n0.000000 4.039934 0.074966\n6.189252 0.000000 0.000000\n0.000000 -0.353904 -9.049563\nH Au C N Cl\n6 2 4 2 2\ndirect\n0.718728 0.647319 0.126651 H\n0.281272 0.147319 0.873348 H\n0.364206 0.793168 0.049680 H\n0.635794 0.293168 0.950319 H\n0.718666 0.939146 0.126586 H\n0.281334 0.439146 0.873413 H\n0.138984 0.793270 0.584827 Au\n0.861016 0.293270 0.415172 Au\n0.323082 0.793292 0.393976 C\n0.676918 0.293293 0.606023 C\n0.565659 0.793225 0.136823 C\n0.434340 0.293225 0.863177 C\n0.430302 0.793275 0.277389 N\n0.569698 0.293275 0.722610 N\n0.920712 0.793212 0.812966 Cl\n0.079288 0.293212 0.187034 Cl\n",
"nsites": 16,
"nelements": 5,
"elements": [
"H",
"Au",
"C",
"N",
"Cl"
],
"chemical_system": "Au-C-Cl-H-N",
"density": 4.016672103646434,
"density_atomic": 0.0707612040779383,
"volume": 226.11260235731953,
"volume_molar": 8.510511993785538,
"formula_full": "H6 Au2 C4 N2 Cl2",
"formula_reduced": "H3AuC2NCl",
"formula_anonymous": "ABCD2E3",
"energy_above_hull": 3.7018793609375,
"spacegroup": 11
},
{
"id": "jvasp-86596",
"created_at": "2022-09-04T14:36:08.166041Z",
"updated_at": "2022-09-04T14:36:08.166062Z",
"structure_string": "Au2 C2 Cl2 O2\n1.0\n3.871824 0.000000 -0.959822\n0.000000 5.275107 -0.000000\n0.000794 -0.000000 8.292384\nAu C Cl O\n2 2 2 2\ndirect\n0.761760 0.250000 0.523521 Au\n0.238238 0.750000 0.476478 Au\n0.880549 0.250000 0.761102 C\n0.119449 0.750000 0.238898 C\n0.379596 0.750000 0.759195 Cl\n0.620402 0.250000 0.240805 Cl\n0.951498 0.250000 0.903000 O\n0.048500 0.750000 0.097000 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Au",
"C",
"Cl",
"O"
],
"chemical_system": "Au-C-Cl-O",
"density": 5.106613132935239,
"density_atomic": 0.047233855070526694,
"volume": 169.37004163761122,
"volume_molar": 12.749627890859447,
"formula_full": "Au2 C2 Cl2 O2",
"formula_reduced": "AuCClO",
"formula_anonymous": "ABCD",
"energy_above_hull": 2.1262837843749995,
"spacegroup": 63
},
{
"id": "jvasp-85998",
"created_at": "2022-09-04T14:36:04.227753Z",
"updated_at": "2022-09-04T14:36:04.227780Z",
"structure_string": "Au2 C2 Cl2 O2\n1.0\n3.777337 -0.000000 -0.936399\n-0.000000 5.363890 -0.000000\n0.053040 0.000000 8.300848\nAu C Cl O\n2 2 2 2\ndirect\n0.762193 0.250000 0.524384 Au\n0.237808 0.750000 0.475616 Au\n0.880665 0.250000 0.761328 C\n0.119336 0.750000 0.238672 C\n0.378786 0.750000 0.757572 Cl\n0.621215 0.250000 0.242428 Cl\n0.951441 0.250000 0.902882 O\n0.048560 0.750000 0.097118 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Au",
"C",
"Cl",
"O"
],
"chemical_system": "Au-C-Cl-O",
"density": 5.134452200260955,
"density_atomic": 0.047491353815219274,
"volume": 168.45171504536657,
"volume_molar": 12.680499240832589,
"formula_full": "Au2 C2 Cl2 O2",
"formula_reduced": "AuCClO",
"formula_anonymous": "ABCD",
"energy_above_hull": 2.1263437843749995,
"spacegroup": 63
},
{
"id": "jvasp-31962",
"created_at": "2022-09-04T14:38:35.594857Z",
"updated_at": "2022-09-04T14:38:35.594885Z",
"structure_string": "Au2 C10 S8 Cl8\n1.0\n8.158447 -0.050845 0.728899\n0.641198 8.409963 2.243800\n0.010168 0.100085 8.727150\nAu C S Cl\n2 10 8 8\ndirect\n0.869085 0.151055 0.151055 Au\n0.130915 0.848944 0.848945 Au\n0.331365 0.658866 0.528780 C\n0.075072 0.520985 0.520986 C\n0.594761 0.051448 0.658568 C\n0.331365 0.528780 0.658867 C\n0.594761 0.658568 0.051448 C\n0.924929 0.479015 0.479015 C\n0.405240 0.341432 0.948552 C\n0.405240 0.948552 0.341432 C\n0.668636 0.471220 0.341133 C\n0.668636 0.341133 0.471220 C\n0.169262 0.687409 0.410166 S\n0.830739 0.589834 0.312591 S\n0.487767 0.478311 0.796984 S\n0.512234 0.521688 0.203016 S\n0.830739 0.312591 0.589834 S\n0.169262 0.410165 0.687409 S\n0.487767 0.796984 0.478312 S\n0.512234 0.203016 0.521688 S\n0.855437 0.382188 0.945712 Cl\n0.683031 0.038099 0.038099 Cl\n0.144564 0.054287 0.617812 Cl\n0.855437 0.945712 0.382188 Cl\n0.079393 0.250392 0.250392 Cl\n0.144564 0.617812 0.054288 Cl\n0.316970 0.961901 0.961901 Cl\n0.920608 0.749608 0.749608 Cl\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Au",
"C",
"S",
"Cl"
],
"chemical_system": "Au-C-Cl-S",
"density": 2.931079748718378,
"density_atomic": 0.046883507109522486,
"volume": 597.2249459621363,
"volume_molar": 12.84490246416921,
"formula_full": "Au2 C10 S8 Cl8",
"formula_reduced": "AuC5(SCl)4",
"formula_anonymous": "AB4C4D5",
"energy_above_hull": 3.4535509885714286,
"spacegroup": 12
},
{
"id": "jvasp-62413",
"created_at": "2022-09-04T14:35:48.102331Z",
"updated_at": "2022-09-04T14:35:48.102354Z",
"structure_string": "Au4 C4 S8 Cl12\n1.0\n5.098832 7.514913 0.061753\n-5.098832 7.514913 0.061753\n0.000000 5.644359 9.095171\nAu C S Cl\n4 4 8 12\ndirect\n0.945366 0.710536 0.539312 Au\n0.289464 0.054634 0.960687 Au\n0.054634 0.289464 0.460687 Au\n0.710536 0.945366 0.039312 Au\n0.251650 0.697415 0.550406 C\n0.302585 0.748350 0.949593 C\n0.748350 0.302585 0.449593 C\n0.697415 0.251650 0.050406 C\n0.147413 0.835145 0.074554 S\n0.164855 0.852587 0.425445 S\n0.548465 0.138576 0.168270 S\n0.861424 0.451535 0.331729 S\n0.451535 0.861424 0.831729 S\n0.138576 0.548465 0.668270 S\n0.852587 0.164855 0.925445 S\n0.835145 0.147413 0.574554 S\n0.896876 0.787446 0.885484 Cl\n0.435834 0.692796 0.554695 Cl\n0.307204 0.564166 0.945304 Cl\n0.564166 0.307204 0.445304 Cl\n0.692796 0.435834 0.054695 Cl\n0.787446 0.896876 0.385484 Cl\n0.539022 0.750085 0.176986 Cl\n0.249915 0.460978 0.323014 Cl\n0.460978 0.249915 0.823013 Cl\n0.750085 0.539022 0.676986 Cl\n0.212554 0.103124 0.614515 Cl\n0.103124 0.212554 0.114515 Cl\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Au",
"C",
"S",
"Cl"
],
"chemical_system": "Au-C-Cl-S",
"density": 3.634688067760092,
"density_atomic": 0.04037782398839657,
"volume": 693.4499493594899,
"volume_molar": 14.914475732348999,
"formula_full": "Au4 C4 S8 Cl12",
"formula_reduced": "AuCS2Cl3",
"formula_anonymous": "ABC2D3",
"energy_above_hull": 1.7064642532142855,
"spacegroup": 15
},
{
"id": "jvasp-86775",
"created_at": "2022-09-04T14:36:03.544487Z",
"updated_at": "2022-09-04T14:36:03.544518Z",
"structure_string": "K1 Co1 Au3 C6 N6\n1.0\n6.717009 -0.000000 0.000000\n-3.358505 5.817100 -0.000000\n0.000000 0.000000 7.597588\nK Co Au C N\n1 1 3 6 6\ndirect\n0.333333 0.666667 0.500000 K\n0.000000 0.000000 0.500000 Co\n0.503714 0.007427 0.000000 Au\n0.992573 0.496286 0.000000 Au\n0.503714 0.496286 0.000000 Au\n0.667493 0.659927 0.782619 C\n0.992435 0.332508 0.782619 C\n0.340073 0.332508 0.217382 C\n0.340073 0.007565 0.782619 C\n0.667493 0.007565 0.217382 C\n0.992436 0.659927 0.217382 C\n0.235704 0.003408 0.657989 N\n0.996593 0.764296 0.342011 N\n0.767704 0.003408 0.342011 N\n0.235704 0.232296 0.342011 N\n0.767704 0.764296 0.657989 N\n0.996593 0.232296 0.657989 N\n",
"nsites": 17,
"nelements": 5,
"elements": [
"K",
"Co",
"Au",
"C",
"N"
],
"chemical_system": "Au-C-Co-K-N",
"density": 4.726785613341592,
"density_atomic": 0.0572651921672871,
"volume": 296.864453896154,
"volume_molar": 10.516232517665705,
"formula_full": "K1 Co1 Au3 C6 N6",
"formula_reduced": "KCoAu3(CN)6",
"formula_anonymous": "ABC3D6E6",
"energy_above_hull": 5.225642418235293,
"spacegroup": 149
},
{
"id": "jvasp-86173",
"created_at": "2022-09-04T14:35:46.745454Z",
"updated_at": "2022-09-04T14:35:46.745484Z",
"structure_string": "K1 Co1 Au3 C6 N6\n1.0\n6.718413 0.000000 -0.000000\n-3.359206 5.818316 0.000000\n0.000000 0.000000 7.596066\nK Co Au C N\n1 1 3 6 6\ndirect\n0.333333 0.666667 0.500000 K\n0.000000 0.000000 0.500000 Co\n0.503688 0.007377 0.000000 Au\n0.992622 0.496312 0.000000 Au\n0.503688 0.496312 0.000000 Au\n0.667498 0.659997 0.782630 C\n0.992498 0.332502 0.782630 C\n0.340003 0.332502 0.217370 C\n0.340003 0.007502 0.782630 C\n0.667498 0.007502 0.217370 C\n0.992498 0.659997 0.217370 C\n0.235635 0.003369 0.657997 N\n0.996631 0.764365 0.342003 N\n0.767733 0.003369 0.342003 N\n0.235635 0.232267 0.342003 N\n0.767733 0.764365 0.657997 N\n0.996631 0.232267 0.657997 N\n",
"nsites": 17,
"nelements": 5,
"elements": [
"K",
"Co",
"Au",
"C",
"N"
],
"chemical_system": "Au-C-Co-K-N",
"density": 4.725756845972342,
"density_atomic": 0.05725272861046124,
"volume": 296.92907940974106,
"volume_molar": 10.518521834956932,
"formula_full": "K1 Co1 Au3 C6 N6",
"formula_reduced": "KCoAu3(CN)6",
"formula_anonymous": "ABC3D6E6",
"energy_above_hull": 5.225648888823529,
"spacegroup": 149
},
{
"id": "jvasp-19648",
"created_at": "2022-09-04T14:38:29.989301Z",
"updated_at": "2022-09-04T14:38:29.989328Z",
"structure_string": "Cd1 Au3\n1.0\n4.195971 0.000000 -0.000000\n0.000000 4.195971 -0.000000\n-0.000000 0.000000 4.194333\nCd Au\n1 3\ndirect\n0.000000 0.000000 0.000000 Cd\n0.000000 0.500000 0.500000 Au\n0.500000 0.000000 0.500000 Au\n0.500000 0.500000 0.000000 Au\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cd",
"Au"
],
"chemical_system": "Au-Cd",
"density": 15.814973306692346,
"density_atomic": 0.054166668844105544,
"volume": 73.84615087762191,
"volume_molar": 11.117797879230917,
"formula_full": "Cd1 Au3",
"formula_reduced": "CdAu3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1071137849999999,
"spacegroup": 221
},
{
"id": "jvasp-15047",
"created_at": "2022-09-04T14:36:38.205689Z",
"updated_at": "2022-09-04T14:36:38.205709Z",
"structure_string": "Cd1 Au1\n1.0\n3.383082 0.000000 -0.000000\n-0.000000 3.383082 -0.000000\n0.000000 0.000000 3.383082\nCd Au\n1 1\ndirect\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.500000 Au\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cd",
"Au"
],
"chemical_system": "Au-Cd",
"density": 13.267843698197426,
"density_atomic": 0.051652627964011114,
"volume": 38.720198348736425,
"volume_molar": 11.658924235560516,
"formula_full": "Cd1 Au1",
"formula_reduced": "CdAu",
"formula_anonymous": "AB",
"energy_above_hull": 0.0080799999999999,
"spacegroup": 221
},
{
"id": "jvasp-4340",
"created_at": "2022-09-04T14:36:34.897351Z",
"updated_at": "2022-09-04T14:36:34.897397Z",
"structure_string": "Cd2 Au2\n1.0\n3.236526 0.000000 0.000000\n0.000000 4.817950 -0.000000\n0.000000 0.000000 4.956070\nCd Au\n2 2\ndirect\n0.000000 0.250000 0.298312 Cd\n0.000000 0.750000 0.701688 Cd\n0.500001 0.250000 0.803431 Au\n0.500001 0.750000 0.196569 Au\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Cd",
"Au"
],
"chemical_system": "Au-Cd",
"density": 13.295023065109572,
"density_atomic": 0.05175843910856063,
"volume": 77.28208324849612,
"volume_molar": 11.635089588712042,
"formula_full": "Cd2 Au2",
"formula_reduced": "CdAu",
"formula_anonymous": "AB",
"energy_above_hull": 0.0056599999999999,
"spacegroup": 51
},
{
"id": "jvasp-98198",
"created_at": "2022-09-04T14:36:17.190018Z",
"updated_at": "2022-09-04T14:36:17.190051Z",
"structure_string": "Cd9 Au9\n1.0\n8.268347 0.000001 -0.000000\n-4.134175 7.160598 -0.000000\n0.000000 0.000000 5.903079\nCd Au\n9 9\ndirect\n0.333358 0.314415 0.213086 Cd\n0.333334 0.666667 0.646198 Cd\n0.666667 0.333333 0.500359 Cd\n0.333339 0.980062 0.914413 Cd\n0.000000 0.000000 0.500364 Cd\n0.646724 0.666662 0.914413 Cd\n0.685585 0.018942 0.213086 Cd\n0.981059 0.666643 0.213086 Cd\n0.019939 0.353276 0.914413 Cd\n0.333334 0.666667 0.153716 Au\n0.333305 0.308503 0.712811 Au\n0.975199 0.666695 0.712811 Au\n0.691497 0.024802 0.712811 Au\n0.644769 0.666684 0.416104 Au\n0.021915 0.355231 0.416104 Au\n0.333317 0.978085 0.416104 Au\n0.666667 0.333333 0.994043 Au\n0.000000 0.000000 0.994084 Au\n",
"nsites": 18,
"nelements": 2,
"elements": [
"Cd",
"Au"
],
"chemical_system": "Au-Cd",
"density": 13.229207134892139,
"density_atomic": 0.05150221316597673,
"volume": 349.4995436796319,
"volume_molar": 11.692974708858397,
"formula_full": "Cd9 Au9",
"formula_reduced": "CdAu",
"formula_anonymous": "AB",
"energy_above_hull": 0.0,
"spacegroup": 157
}
]
}