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=109",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=107",
"results": [
{
"id": "jvasp-16839",
"created_at": "2022-09-04T14:38:31.916614Z",
"updated_at": "2022-09-04T14:38:31.916637Z",
"structure_string": "Se2\n1.0\n3.877363 -0.000000 2.238597\n1.292454 3.655613 2.238597\n-0.000000 -0.000000 4.477193\nSe\n2\ndirect\n0.874999 0.874999 0.875002 Se\n0.125000 0.125000 0.125000 Se\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Se"
],
"chemical_system": "Se",
"density": 4.132222916848017,
"density_atomic": 0.0315157396980195,
"volume": 63.46035406954714,
"volume_molar": 19.108359244312584,
"formula_full": "Se2",
"formula_reduced": "Se",
"formula_anonymous": "A",
"energy_above_hull": 0.5344433666666666,
"spacegroup": 227
},
{
"id": "jvasp-28354",
"created_at": "2022-09-04T14:38:08.235994Z",
"updated_at": "2022-09-04T14:38:08.236011Z",
"structure_string": "Se2\n1.0\n2.821044 -0.000000 0.000000\n-1.410521 3.903419 -0.000000\n-0.000000 0.000000 4.677285\nSe\n2\ndirect\n0.066961 0.133919 0.250000 Se\n0.933039 0.866081 0.750001 Se\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Se"
],
"chemical_system": "Se",
"density": 5.091401751697326,
"density_atomic": 0.03883122850180814,
"volume": 51.50493757638577,
"volume_molar": 15.50849919600042,
"formula_full": "Se2",
"formula_reduced": "Se",
"formula_anonymous": "A",
"energy_above_hull": 0.1658233666666666,
"spacegroup": 63
},
{
"id": "jvasp-25043",
"created_at": "2022-09-04T14:38:14.822295Z",
"updated_at": "2022-09-04T14:38:14.822317Z",
"structure_string": "Se3\n1.0\n4.236454 -0.000000 -0.000000\n-2.118227 3.668877 0.000000\n-0.000000 0.000000 5.131578\nSe\n3\ndirect\n0.237168 0.000000 0.333333 Se\n-0.000000 0.237168 0.666667 Se\n0.762831 0.762833 0.000000 Se\n",
"nsites": 3,
"nelements": 1,
"elements": [
"Se"
],
"chemical_system": "Se",
"density": 4.9316348165232196,
"density_atomic": 0.037612714098635945,
"volume": 79.76026383346787,
"volume_molar": 16.010917861996028,
"formula_full": "Se3",
"formula_reduced": "Se",
"formula_anonymous": "A",
"energy_above_hull": 3.3666666665599365e-06,
"spacegroup": 152
},
{
"id": "jvasp-25189",
"created_at": "2022-09-04T14:38:30.311813Z",
"updated_at": "2022-09-04T14:38:30.311844Z",
"structure_string": "Se32\n1.0\n8.115828 0.000000 0.000000\n0.000000 9.225852 -0.374265\n0.000000 0.196291 13.008826\nSe\n32\ndirect\n0.691912 0.558107 0.413960 Se\n0.022795 0.336392 0.213480 Se\n0.522795 0.663607 0.286520 Se\n0.256997 0.633253 0.837896 Se\n0.756997 0.366747 0.662104 Se\n0.743003 0.366747 0.162104 Se\n0.243003 0.633253 0.337896 Se\n0.345974 0.860926 0.905361 Se\n0.845974 0.139074 0.594640 Se\n0.654026 0.139074 0.094640 Se\n0.154026 0.860926 0.405361 Se\n0.334965 0.842894 0.089013 Se\n0.834965 0.157105 0.410987 Se\n0.665035 0.157105 0.910988 Se\n0.165035 0.842894 0.589013 Se\n0.084506 0.954786 0.144296 Se\n0.584506 0.045214 0.355704 Se\n0.915494 0.045214 0.855704 Se\n0.415494 0.954786 0.644296 Se\n0.898201 0.760367 0.169389 Se\n0.398201 0.239633 0.330612 Se\n0.101799 0.239633 0.830612 Se\n0.601799 0.760367 0.669389 Se\n0.722810 0.754827 0.021796 Se\n0.222809 0.245173 0.478204 Se\n0.277191 0.245173 0.978205 Se\n0.777191 0.754827 0.521796 Se\n0.808088 0.558107 0.913960 Se\n0.308088 0.441892 0.586040 Se\n0.191912 0.441892 0.086040 Se\n0.477205 0.336392 0.713480 Se\n0.977205 0.663607 0.786521 Se\n",
"nsites": 32,
"nelements": 1,
"elements": [
"Se"
],
"chemical_system": "Se",
"density": 4.3048996752078335,
"density_atomic": 0.03283271505919311,
"volume": 974.6376424340225,
"volume_molar": 18.341890852288227,
"formula_full": "Se32",
"formula_reduced": "Se",
"formula_anonymous": "A",
"energy_above_hull": 0.0557833666666667,
"spacegroup": 14
},
{
"id": "jvasp-25137",
"created_at": "2022-09-04T14:38:16.712108Z",
"updated_at": "2022-09-04T14:38:16.712127Z",
"structure_string": "Se1\n1.0\n2.831476 -0.000000 -1.001078\n-1.415739 2.452131 -1.001078\n0.000000 0.000000 3.003234\nSe\n1\ndirect\n0.000000 0.000000 0.000000 Se\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Se"
],
"chemical_system": "Se",
"density": 6.287970746016006,
"density_atomic": 0.047957250431049446,
"volume": 20.8519043734117,
"volume_molar": 12.557310325074486,
"formula_full": "Se1",
"formula_reduced": "Se",
"formula_anonymous": "A",
"energy_above_hull": 0.5330133666666665,
"spacegroup": 229
},
{
"id": "jvasp-25110",
"created_at": "2022-09-04T14:37:56.636091Z",
"updated_at": "2022-09-04T14:37:56.636120Z",
"structure_string": "Se2\n1.0\n2.821262 -0.000000 0.000000\n-1.410630 3.904159 -0.000000\n-0.000000 0.000000 4.676979\nSe\n2\ndirect\n0.066956 0.133912 0.250000 Se\n0.933043 0.866089 0.750000 Se\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Se"
],
"chemical_system": "Se",
"density": 5.090376405469285,
"density_atomic": 0.03882340836589737,
"volume": 51.51531213206946,
"volume_molar": 15.511623047732902,
"formula_full": "Se2",
"formula_reduced": "Se",
"formula_anonymous": "A",
"energy_above_hull": 0.1658333666666667,
"spacegroup": 63
},
{
"id": "jvasp-25049",
"created_at": "2022-09-04T14:38:13.398210Z",
"updated_at": "2022-09-04T14:38:13.398237Z",
"structure_string": "Se6\n1.0\n5.990791 0.068581 -2.805652\n-4.431327 4.032072 -2.805654\n0.026079 0.068582 6.615178\nSe\n6\ndirect\n0.292592 0.162600 0.913857 Se\n0.913857 0.292592 0.162601 Se\n0.162600 0.913857 0.292592 Se\n0.707407 0.837399 0.086143 Se\n0.086142 0.707407 0.837399 Se\n0.837399 0.086142 0.707408 Se\n",
"nsites": 6,
"nelements": 1,
"elements": [
"Se"
],
"chemical_system": "Se",
"density": 4.794085724583848,
"density_atomic": 0.036563651290435165,
"volume": 164.0973969568943,
"volume_molar": 16.47029371373355,
"formula_full": "Se6",
"formula_reduced": "Se",
"formula_anonymous": "A",
"energy_above_hull": 0.0440833666666666,
"spacegroup": 148
},
{
"id": "jvasp-25188",
"created_at": "2022-09-04T14:38:30.028413Z",
"updated_at": "2022-09-04T14:38:30.028441Z",
"structure_string": "Se32\n1.0\n9.076645 0.000000 -0.133577\n0.000000 9.021531 0.000000\n-0.013633 0.000000 11.704397\nSe\n32\ndirect\n0.323834 0.478126 0.230963 Se\n0.369018 0.102007 0.370604 Se\n0.130983 0.602007 0.129396 Se\n0.417404 0.981959 0.725042 Se\n0.082596 0.481959 0.774958 Se\n0.582597 0.018041 0.274958 Se\n0.917404 0.518041 0.225042 Se\n0.338977 0.768535 0.829668 Se\n0.161023 0.268535 0.670332 Se\n0.661023 0.231465 0.170332 Se\n0.838978 0.731465 0.329668 Se\n0.411321 0.811278 0.021884 Se\n0.088680 0.311278 0.478116 Se\n0.588680 0.188722 0.978116 Se\n0.911321 0.688722 0.521884 Se\n0.634772 0.680256 0.057340 Se\n0.865229 0.180256 0.442659 Se\n0.365229 0.319744 0.942660 Se\n0.134772 0.819744 0.557341 Se\n0.822960 0.865845 0.040307 Se\n0.677041 0.365845 0.459692 Se\n0.177041 0.134155 0.959693 Se\n0.322960 0.634155 0.540308 Se\n0.933277 0.846122 0.857904 Se\n0.566724 0.346122 0.642096 Se\n0.066724 0.153878 0.142096 Se\n0.433277 0.653878 0.357904 Se\n0.823835 0.021874 0.730963 Se\n0.676167 0.521874 0.769037 Se\n0.176166 0.978126 0.269037 Se\n0.869018 0.397993 0.870604 Se\n0.630983 0.897993 0.629396 Se\n",
"nsites": 32,
"nelements": 1,
"elements": [
"Se"
],
"chemical_system": "Se",
"density": 4.377831280943901,
"density_atomic": 0.03338895162928836,
"volume": 958.4008613175507,
"volume_molar": 18.03632778549853,
"formula_full": "Se32",
"formula_reduced": "Se",
"formula_anonymous": "A",
"energy_above_hull": 0.0541533666666667,
"spacegroup": 14
},
{
"id": "jvasp-100313",
"created_at": "2022-09-04T14:36:33.486825Z",
"updated_at": "2022-09-04T14:36:33.486854Z",
"structure_string": "Zr1 Sc1\n1.0\n3.247301 -0.000000 0.000000\n-1.623650 2.812245 -0.000000\n0.000000 0.000000 5.127412\nZr Sc\n1 1\ndirect\n0.000000 0.000000 0.000000 Zr\n0.333334 0.666668 0.500000 Sc\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zr",
"Sc"
],
"chemical_system": "Sc-Zr",
"density": 4.829344998680477,
"density_atomic": 0.04271260708511297,
"volume": 46.82458263469192,
"volume_molar": 14.09921138271832,
"formula_full": "Zr1 Sc1",
"formula_reduced": "ZrSc",
"formula_anonymous": "AB",
"energy_above_hull": 2.300749875,
"spacegroup": 187
},
{
"id": "jvasp-94303",
"created_at": "2022-09-04T14:36:04.649523Z",
"updated_at": "2022-09-04T14:36:04.649557Z",
"structure_string": "Zr2 Sc4\n1.0\n0.000000 3.255708 0.000000\n5.709200 -1.627854 1.337994\n0.013919 0.000000 -7.598304\nZr Sc\n2 4\ndirect\n0.473553 0.947103 0.192942 Zr\n0.526449 0.052897 0.807058 Zr\n0.807952 0.615902 0.862332 Sc\n0.192049 0.384098 0.137668 Sc\n0.865988 0.731974 0.474000 Sc\n0.134014 0.268026 0.526000 Sc\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Zr",
"Sc"
],
"chemical_system": "Sc-Zr",
"density": 4.2575491331571715,
"density_atomic": 0.0424646427445776,
"volume": 141.2940180867565,
"volume_molar": 14.18154109107389,
"formula_full": "Zr2 Sc4",
"formula_reduced": "ZrSc2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.808898333333333,
"spacegroup": 12
},
{
"id": "jvasp-123437",
"created_at": "2022-09-04T14:38:54.494744Z",
"updated_at": "2022-09-04T14:38:54.494774Z",
"structure_string": "Zr1 Sc1\n1.0\n1.622212 -2.809752 -0.000000\n1.622212 2.809752 -0.000000\n-0.000000 0.000000 5.121352\nZr Sc\n1 1\ndirect\n0.333333 0.666666 0.750000 Zr\n0.666666 0.333333 0.250000 Sc\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zr",
"Sc"
],
"chemical_system": "Sc-Zr",
"density": 4.8436407641822745,
"density_atomic": 0.04283904440011657,
"volume": 46.686382201246246,
"volume_molar": 14.057598259553178,
"formula_full": "Zr1 Sc1",
"formula_reduced": "ZrSc",
"formula_anonymous": "AB",
"energy_above_hull": 2.294909875,
"spacegroup": 187
},
{
"id": "jvasp-91058",
"created_at": "2022-09-04T14:35:42.142400Z",
"updated_at": "2022-09-04T14:35:42.142432Z",
"structure_string": "Zr1 Sc1 Zn2\n1.0\n-9.916595 0.000001 -5.725349\n-6.417359 0.273816 -0.335506\n-5.573729 2.659961 -1.796715\nZr Sc Zn\n1 1 2\ndirect\n0.500000 0.000000 -0.000000 Zr\n0.000000 0.000000 0.000000 Sc\n0.750257 0.000001 -0.000000 Zn\n0.249743 0.000000 -0.000000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Zr",
"Sc",
"Zn"
],
"chemical_system": "Sc-Zn-Zr",
"density": 5.214647177572755,
"density_atomic": 0.047046569155090874,
"volume": 85.02214022905352,
"volume_molar": 12.800382404395474,
"formula_full": "Zr1 Sc1 Zn2",
"formula_reduced": "ZrScZn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0391951375,
"spacegroup": 71
}
]
}