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=elements&page=4574",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=elements&page=4572",
"results": [
{
"id": "jvasp-112004",
"created_at": "2022-09-04T14:38:41.607554Z",
"updated_at": "2022-09-04T14:38:41.607584Z",
"structure_string": "H10 C12 S2 N2 O2\n1.0\n3.900341 0.009693 -0.805156\n-1.060863 7.612435 -2.720235\n-0.146508 -0.031679 9.559693\nH C S N O\n10 12 2 2 2\ndirect\n0.579257 0.809193 0.910429 H\n0.079253 0.309193 0.410428 H\n0.269919 0.304896 0.857548 H\n0.769919 0.804898 0.357548 H\n0.323646 0.089384 0.012901 H\n0.823649 0.589385 0.512901 H\n0.354692 0.624553 0.748944 H\n0.854690 0.124552 0.248943 H\n0.797441 0.466843 0.783217 H\n0.297443 0.966844 0.283218 H\n0.509054 0.140430 0.504031 C\n0.009059 0.640430 0.004031 C\n0.107601 0.208071 0.305427 C\n0.607604 0.708071 0.805427 C\n0.635920 -0.003517 0.551354 C\n0.135923 0.496483 0.051354 C\n0.730887 0.837908 0.472535 C\n0.189491 0.293844 0.197518 C\n0.230887 0.337907 0.972534 C\n0.763337 0.722845 0.556574 C\n0.263336 0.222844 0.056574 C\n0.689492 0.793844 0.697519 C\n0.096424 0.504498 0.229633 S\n0.596422 0.004497 0.729632 S\n0.848123 0.596842 0.853139 N\n0.348120 0.096842 0.353140 N\n0.025191 0.791571 0.100679 O\n0.525181 0.291570 0.600679 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 1.6351107145697654,
"density_atomic": 0.0990523703151906,
"volume": 282.6787477261,
"volume_molar": 6.079754316668231,
"formula_full": "H10 C12 S2 N2 O2",
"formula_reduced": "H5C6SNO",
"formula_anonymous": "ABCD5E6",
"energy_above_hull": 5.158084053571429,
"spacegroup": 1
},
{
"id": "jvasp-101850",
"created_at": "2022-09-04T14:37:10.851511Z",
"updated_at": "2022-09-04T14:37:10.851539Z",
"structure_string": "H2 C4 S2 N2 O4\n1.0\n4.549051 -0.018487 1.033105\n0.695555 5.803559 1.654811\n-0.064320 -0.207336 6.256704\nH C S N O\n2 4 2 2 4\ndirect\n0.658278 0.621099 0.138002 H\n0.658238 0.121047 0.638049 H\n0.114490 0.711133 0.261079 C\n0.114464 0.211073 0.761105 C\n0.809950 0.348851 0.787036 C\n0.809977 0.848917 0.286984 C\n0.181655 0.444270 0.247672 S\n0.181645 0.944232 0.747607 S\n0.607415 0.740730 0.238323 N\n0.607380 0.240661 0.738388 N\n0.756335 0.529540 0.852712 O\n0.756358 0.029609 0.352657 O\n0.318589 0.850708 0.255875 O\n0.318552 0.350631 0.755961 O\n",
"nsites": 14,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 2.049564745890217,
"density_atomic": 0.08380165459543817,
"volume": 167.0611405894855,
"volume_molar": 7.186183601114506,
"formula_full": "H2 C4 S2 N2 O4",
"formula_reduced": "HC2SNO2",
"formula_anonymous": "ABCD2E2",
"energy_above_hull": 4.300678607142857,
"spacegroup": 1
},
{
"id": "jvasp-101842",
"created_at": "2022-09-04T14:37:04.343228Z",
"updated_at": "2022-09-04T14:37:04.343253Z",
"structure_string": "H10 C18 S4 N2 O2\n1.0\n4.679759 -0.132615 -0.475027\n-0.718930 7.747461 -2.245204\n-0.227162 0.235148 10.587951\nH C S N O\n10 18 4 2 2\ndirect\n0.602214 0.834438 0.485368 H\n0.548799 0.915245 0.861605 H\n0.956860 0.068675 0.602727 H\n0.460720 0.066294 0.103178 H\n0.707139 0.579425 0.854382 H\n0.054061 0.912227 0.362020 H\n0.341197 0.330438 0.731447 H\n0.843028 0.329216 0.231664 H\n0.101908 0.834813 0.985552 H\n0.208669 0.578268 0.354404 H\n0.321370 0.062116 0.292751 C\n0.319415 0.444482 0.030840 C\n0.818534 0.444906 0.530729 C\n0.179221 0.314780 0.913768 C\n0.679255 0.314609 0.413823 C\n0.940450 0.812812 0.167156 C\n0.438450 0.813992 0.666838 C\n0.819593 0.063251 0.792480 C\n0.560955 0.573873 0.042134 C\n0.189405 0.265946 0.779037 C\n0.690775 0.265004 0.279220 C\n0.945646 0.772295 0.031681 C\n0.445199 0.772430 0.531461 C\n0.984034 0.123330 0.709215 C\n0.486338 0.121877 0.209522 C\n0.730834 0.634558 0.961184 C\n0.231090 0.634215 0.461072 C\n0.060150 0.574242 0.541962 C\n0.166324 0.687808 0.706385 S\n0.668891 0.686262 0.206710 S\n0.413902 0.182802 0.455052 S\n0.914315 0.182710 0.955025 S\n0.602336 0.930336 0.774168 N\n0.105468 0.928469 0.274538 N\n0.720736 0.443687 0.637257 O\n0.222533 0.442557 0.137456 O\n",
"nsites": 36,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 1.790210341447246,
"density_atomic": 0.09362387704795544,
"volume": 384.51729553520096,
"volume_molar": 6.432270217687499,
"formula_full": "H10 C18 S4 N2 O2",
"formula_reduced": "H5C9S2NO",
"formula_anonymous": "ABC2D5E9",
"energy_above_hull": 5.484352041666666,
"spacegroup": 1
},
{
"id": "jvasp-101855",
"created_at": "2022-09-04T14:37:13.095276Z",
"updated_at": "2022-09-04T14:37:13.095307Z",
"structure_string": "H2 C4 S2 N2 O4\n1.0\n4.616567 0.011067 0.531423\n0.946582 5.993122 2.045002\n-0.092777 -0.053849 6.446713\nH C S N O\n2 4 2 2 4\ndirect\n0.431495 0.188086 0.596748 H\n0.431547 0.688087 0.096738 H\n0.915271 0.242000 0.718390 C\n0.629726 0.248191 0.851811 C\n0.915317 0.742007 0.218376 C\n0.629772 0.748192 0.351802 C\n0.599513 0.276588 0.098853 S\n0.599559 0.776580 0.598846 S\n0.411001 0.234663 0.737259 N\n0.411048 0.734670 0.237244 N\n0.949106 0.249159 0.527200 O\n0.949147 0.749182 0.027185 O\n0.139425 0.728085 0.348713 O\n0.139377 0.228093 0.848722 O\n",
"nsites": 14,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 1.9120889657253952,
"density_atomic": 0.07818060853299391,
"volume": 179.07253809736844,
"volume_molar": 7.702857361948681,
"formula_full": "H2 C4 S2 N2 O4",
"formula_reduced": "HC2SNO2",
"formula_anonymous": "ABCD2E2",
"energy_above_hull": 4.297761464285714,
"spacegroup": 1
},
{
"id": "jvasp-104165",
"created_at": "2022-09-04T14:36:57.989322Z",
"updated_at": "2022-09-04T14:36:57.989342Z",
"structure_string": "H10 C10 S2 N2 O2\n1.0\n5.113303 -0.056994 0.742163\n1.675890 5.934046 0.711094\n0.183766 0.036950 8.575815\nH C S N O\n10 10 2 2 2\ndirect\n0.407465 0.898127 0.700706 H\n0.407464 0.398127 0.200706 H\n0.200321 0.355051 0.497516 H\n0.200321 0.855051 0.997516 H\n0.794401 0.199383 0.646809 H\n0.794401 0.699383 0.146809 H\n0.698725 0.839217 0.806499 H\n0.698725 0.339217 0.306499 H\n0.718458 0.700672 0.487329 H\n0.718458 0.200672 0.987329 H\n0.607356 0.282905 0.216810 C\n0.607357 0.782906 0.716810 C\n0.335456 0.552788 0.870218 C\n0.335455 0.052788 0.370218 C\n0.958886 0.397532 0.020371 C\n0.951586 0.106080 0.561459 C\n0.951586 0.606081 0.061459 C\n0.170439 0.694783 0.976717 C\n0.170439 0.194782 0.476717 C\n0.958886 0.897532 0.520371 C\n0.233653 0.805954 0.373122 S\n0.233654 0.305954 0.873123 S\n0.796909 0.750271 0.574410 N\n0.796909 0.250271 0.074410 N\n0.564082 0.061654 0.267870 O\n0.564083 0.561655 0.767870 O\n",
"nsites": 26,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 1.6235290395179864,
"density_atomic": 0.09995145280157079,
"volume": 260.1262840232713,
"volume_molar": 6.025065760630303,
"formula_full": "H10 C10 S2 N2 O2",
"formula_reduced": "H5C5SNO",
"formula_anonymous": "ABCD5E5",
"energy_above_hull": 4.957261288461538,
"spacegroup": 1
},
{
"id": "jvasp-101821",
"created_at": "2022-09-04T14:36:51.146230Z",
"updated_at": "2022-09-04T14:36:51.146249Z",
"structure_string": "H10 C12 S2 N2 O2\n1.0\n5.118479 0.103579 -0.720583\n-0.891901 7.283854 -1.453439\n-0.194540 -0.062025 7.529260\nH C S N O\n10 12 2 2 2\ndirect\n0.936777 0.948707 0.859179 H\n0.936775 0.448706 0.359179 H\n0.177029 0.772462 0.338580 H\n0.177026 0.272463 0.838582 H\n0.848535 0.961455 0.159646 H\n0.848533 0.461456 0.659648 H\n0.677709 0.090460 0.707041 H\n0.677708 0.590459 0.207041 H\n0.144740 0.961990 0.699541 H\n0.144738 0.461990 0.199542 H\n0.761743 0.340521 0.076810 C\n0.761745 0.840522 0.576810 C\n0.995109 0.368303 0.235116 C\n0.995110 0.868303 0.735115 C\n0.426964 0.528468 0.954059 C\n0.426964 0.028468 0.454059 C\n0.212189 0.418839 0.843834 C\n0.120296 0.205379 0.281732 C\n0.212191 0.918838 0.343833 C\n0.036401 0.521069 0.747260 C\n0.036402 0.021069 0.247260 C\n0.120296 0.705379 0.781732 C\n0.420903 0.253970 0.431343 S\n0.420904 0.753970 0.931342 S\n0.630566 0.992752 0.585378 N\n0.630565 0.492752 0.085378 N\n0.703754 0.701894 0.450180 O\n0.703753 0.201894 0.950180 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 1.651282862409086,
"density_atomic": 0.10003205295215128,
"volume": 279.91028049172746,
"volume_molar": 6.020211104615232,
"formula_full": "H10 C12 S2 N2 O2",
"formula_reduced": "H5C6SNO",
"formula_anonymous": "ABCD5E6",
"energy_above_hull": 5.159081196428572,
"spacegroup": 1
},
{
"id": "jvasp-101832",
"created_at": "2022-09-04T14:36:57.295228Z",
"updated_at": "2022-09-04T14:36:57.295247Z",
"structure_string": "H10 C10 S2 N2 O2\n1.0\n5.442117 -0.076457 2.128799\n0.106997 6.253100 2.644387\n0.154999 -0.237552 7.722740\nH C S N O\n10 10 2 2 2\ndirect\n0.880621 0.171396 0.010330 H\n0.880624 0.671396 0.510331 H\n0.707855 0.728881 0.848282 H\n0.707854 0.228881 0.348281 H\n0.420553 0.964787 0.060289 H\n0.420551 0.464788 0.560288 H\n0.013152 0.429325 0.875374 H\n0.013153 0.929326 0.375374 H\n0.724986 0.257489 0.723682 H\n0.724986 0.757485 0.223684 H\n0.949138 0.792868 0.361863 C\n0.949137 0.292868 0.861862 C\n0.422756 0.989903 0.520325 C\n0.422756 0.489904 0.020324 C\n0.156009 0.211618 0.718714 C\n0.530086 0.680441 0.966411 C\n0.530085 0.180441 0.466411 C\n0.374004 0.306518 0.580105 C\n0.374005 0.806518 0.080106 C\n0.156010 0.711618 0.218714 C\n0.135017 0.461253 0.209410 S\n0.135018 0.961252 0.709411 S\n0.740662 0.363886 0.785259 N\n0.740663 0.863884 0.285261 N\n0.502889 0.321177 0.957004 O\n0.502890 0.821176 0.457007 O\n",
"nsites": 26,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 1.5988667075566507,
"density_atomic": 0.098433133234129,
"volume": 264.138701530078,
"volume_molar": 6.118001695299065,
"formula_full": "H10 C10 S2 N2 O2",
"formula_reduced": "H5C5SNO",
"formula_anonymous": "ABCD5E5",
"energy_above_hull": 4.964115903846154,
"spacegroup": 1
},
{
"id": "jvasp-104132",
"created_at": "2022-09-04T14:36:57.659131Z",
"updated_at": "2022-09-04T14:36:57.659161Z",
"structure_string": "H10 C10 S2 N2 O2\n1.0\n3.784185 -0.024744 0.020346\n1.344070 6.869424 2.058200\n-0.083174 -0.095655 9.742997\nH C S N O\n10 10 2 2 2\ndirect\n0.679983 0.206358 0.782035 H\n0.679952 0.706370 0.282033 H\n0.362029 0.648543 0.558886 H\n0.362047 0.148546 0.058889 H\n0.295075 0.924794 0.686558 H\n0.295071 0.424800 0.186559 H\n0.572264 0.313792 0.560737 H\n0.572244 0.813787 0.060734 H\n0.129817 0.079026 0.830730 H\n0.129781 0.579029 0.330727 H\n0.961289 0.223782 0.789809 C\n0.961262 0.723787 0.289806 C\n0.015375 0.346534 0.883514 C\n0.015360 0.846537 0.383512 C\n0.940237 0.608509 0.006151 C\n0.204981 0.793134 0.513113 C\n0.204992 0.293135 0.013115 C\n0.163458 0.441635 0.083739 C\n0.163459 0.941633 0.583738 C\n0.940243 0.108510 0.506152 C\n0.796232 0.086978 0.342709 S\n0.796236 0.586973 0.842708 S\n0.835103 0.291074 0.531670 N\n0.835084 0.791074 0.031668 N\n0.054511 0.320102 0.643047 O\n0.054486 0.820107 0.143044 O\n",
"nsites": 26,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 1.6603786663865274,
"density_atomic": 0.10222007482868277,
"volume": 254.35316931214422,
"volume_molar": 5.891348416730172,
"formula_full": "H10 C10 S2 N2 O2",
"formula_reduced": "H5C5SNO",
"formula_anonymous": "ABCD5E5",
"energy_above_hull": 4.964055903846154,
"spacegroup": 1
},
{
"id": "jvasp-103814",
"created_at": "2022-09-04T14:36:52.971144Z",
"updated_at": "2022-09-04T14:36:52.971175Z",
"structure_string": "H6 C4 S2 N2 O2\n1.0\n4.167958 0.067750 0.135451\n1.943747 6.206531 0.178332\n-0.101585 -0.242082 6.816741\nH C S N O\n6 4 2 2 2\ndirect\n0.895900 0.967169 0.157218 H\n0.895902 0.467169 0.657214 H\n0.657599 0.869176 0.332894 H\n0.657601 0.369179 0.832893 H\n0.171987 0.777864 0.537813 H\n0.171994 0.277865 0.037810 H\n0.915717 0.852149 0.276744 C\n0.915719 0.352151 0.776743 C\n0.080203 0.124435 0.699983 C\n0.080203 0.624434 0.199982 C\n0.364186 0.933689 0.817170 S\n0.364186 0.433688 0.317168 S\n0.138099 0.890562 0.427996 N\n0.138102 0.390566 0.927992 N\n0.960141 0.098782 0.523448 O\n0.960141 0.598783 0.023447 O\n",
"nsites": 16,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 1.685031646154789,
"density_atomic": 0.0910944057089019,
"volume": 175.64196039797483,
"volume_molar": 6.610878805493437,
"formula_full": "H6 C4 S2 N2 O2",
"formula_reduced": "H3C2SNO",
"formula_anonymous": "ABCD2E3",
"energy_above_hull": 4.25771459375,
"spacegroup": 1
},
{
"id": "jvasp-103812",
"created_at": "2022-09-04T14:36:51.521833Z",
"updated_at": "2022-09-04T14:36:51.521851Z",
"structure_string": "H6 C6 S2 N2 O2\n1.0\n4.827502 0.027834 0.942208\n0.743944 5.992790 1.536424\n-0.160107 -0.292305 6.489792\nH C S N O\n6 6 2 2 2\ndirect\n0.261014 -0.031903 0.296225 H\n0.625742 0.540958 0.276430 H\n0.639041 0.717658 0.032562 H\n0.297443 0.547144 0.684348 H\n0.601463 0.150466 0.880014 H\n0.667714 0.142269 0.609654 H\n0.813449 0.832318 0.259921 C\n0.837822 0.396313 0.700928 C\n0.609422 0.258019 0.722528 C\n0.124995 0.262128 0.715063 C\n0.596458 0.717399 0.205705 C\n0.107326 0.704200 0.236080 C\n0.163953 0.452041 0.173745 S\n0.164643 0.986602 0.757072 S\n0.310178 0.812091 0.260382 N\n0.335756 0.378768 0.696417 N\n0.800947 0.599294 0.676322 O\n0.767132 0.017771 0.305732 O\n",
"nsites": 18,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 1.7632090017830084,
"density_atomic": 0.09449960575853261,
"volume": 190.4769851209113,
"volume_molar": 6.372662310769742,
"formula_full": "H6 C6 S2 N2 O2",
"formula_reduced": "H3C3SNO",
"formula_anonymous": "ABCD3E3",
"energy_above_hull": 4.620888527777778,
"spacegroup": 1
},
{
"id": "jvasp-103838",
"created_at": "2022-09-04T14:36:57.709216Z",
"updated_at": "2022-09-04T14:36:57.709231Z",
"structure_string": "H3 C5 S2 N1 O1\n1.0\n4.506539 -0.063622 -0.500701\n-2.252441 5.269644 -1.355491\n0.119485 -0.089849 5.967313\nH C S N O\n3 5 2 1 1\ndirect\n0.147593 0.008608 0.892508 H\n0.793593 0.239858 0.205727 H\n0.637184 0.472453 0.585358 H\n0.640133 0.142129 0.311284 C\n0.554593 0.266281 0.509735 C\n0.365486 0.095534 0.617548 C\n0.509634 0.875846 0.256018 C\n0.553750 0.698796 0.061654 C\n0.273278 0.778643 0.459656 S\n0.179207 0.413423 0.936608 S\n0.274610 0.155920 0.830018 N\n0.792719 0.746245 0.966476 O\n",
"nsites": 12,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 1.8576597242768917,
"density_atomic": 0.08539033129088533,
"volume": 140.5311329583856,
"volume_molar": 7.0524855319806115,
"formula_full": "H3 C5 S2 N1 O1",
"formula_reduced": "H3C5S2NO",
"formula_anonymous": "ABC2D3E5",
"energy_above_hull": 5.0047405625,
"spacegroup": 1
},
{
"id": "jvasp-101854",
"created_at": "2022-09-04T14:36:40.363133Z",
"updated_at": "2022-09-04T14:36:40.363151Z",
"structure_string": "H2 C6 S4 N2 O2\n1.0\n4.127794 -0.002097 0.356320\n0.113596 4.425245 0.046546\n-0.027881 -0.066929 12.106913\nH C S N O\n2 6 4 2 2\ndirect\n0.921696 0.730591 0.361114 H\n0.421681 0.730600 0.861114 H\n0.857660 0.688396 0.197195 C\n0.357649 0.688405 0.697195 C\n0.389645 0.165489 0.806716 C\n0.889657 0.165480 0.306717 C\n0.734356 0.372850 0.225102 C\n0.234346 0.372859 0.725101 C\n0.464072 0.296460 0.930161 S\n0.964076 0.296451 0.430162 S\n0.916792 0.793562 0.067931 S\n0.416790 0.793569 0.567931 S\n0.895441 0.860450 0.289915 N\n0.395423 0.860459 0.789915 N\n0.482864 0.293576 0.188113 O\n0.982852 0.293583 0.688111 O\n",
"nsites": 16,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 1.9693969545015626,
"density_atomic": 0.07233013977342088,
"volume": 221.20792314408757,
"volume_molar": 8.325907815005982,
"formula_full": "H2 C6 S4 N2 O2",
"formula_reduced": "HC3S2NO",
"formula_anonymous": "ABCD2E3",
"energy_above_hull": 4.6695533437500005,
"spacegroup": 1
}
]
}