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=4055",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=4053",
"results": [
{
"id": "jvasp-20166",
"created_at": "2022-09-04T14:38:17.332839Z",
"updated_at": "2022-09-04T14:38:17.332861Z",
"structure_string": "Mo8 C4\n1.0\n4.748845 -0.000000 0.000000\n0.000000 5.234906 0.000000\n0.000000 0.000000 6.075019\nMo C\n8 4\ndirect\n0.244718 0.079678 0.878354 Mo\n0.744719 0.920323 0.621647 Mo\n0.255282 0.579679 0.621647 Mo\n0.755283 0.420322 0.878354 Mo\n0.244718 0.579679 0.121647 Mo\n0.744719 0.420322 0.378354 Mo\n0.255282 0.079678 0.378354 Mo\n0.755283 0.920323 0.121647 Mo\n0.500000 0.750001 0.877040 C\n0.000000 0.250000 0.622960 C\n0.500000 0.250000 0.122960 C\n0.000000 0.750001 0.377040 C\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Mo",
"C"
],
"chemical_system": "C-Mo",
"density": 8.967305853359289,
"density_atomic": 0.07945783418110336,
"volume": 151.02349722557423,
"volume_molar": 7.579039652998979,
"formula_full": "Mo8 C4",
"formula_reduced": "Mo2C",
"formula_anonymous": "AB2",
"energy_above_hull": 5.277277266666667,
"spacegroup": 60
},
{
"id": "jvasp-36324",
"created_at": "2022-09-04T14:37:18.323792Z",
"updated_at": "2022-09-04T14:37:18.323813Z",
"structure_string": "Mo1 C1\n1.0\n2.346564 2.346564 0.000000\n2.346564 0.000000 -2.346564\n0.000000 2.346564 -2.346564\nMo C\n1 1\ndirect\n0.000000 0.000000 0.000000 Mo\n0.749999 0.749999 0.749999 C\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Mo",
"C"
],
"chemical_system": "C-Mo",
"density": 6.93661121558749,
"density_atomic": 0.07739319736157063,
"volume": 25.842064524822103,
"volume_molar": 7.781227504874061,
"formula_full": "Mo1 C1",
"formula_reduced": "MoC",
"formula_anonymous": "AB",
"energy_above_hull": 4.20247795,
"spacegroup": 216
},
{
"id": "jvasp-22722",
"created_at": "2022-09-04T14:35:55.789957Z",
"updated_at": "2022-09-04T14:35:55.789984Z",
"structure_string": "Mo4 Br12\n1.0\n6.769367 0.000000 -0.000000\n0.000000 11.636513 0.000000\n0.000000 0.000000 5.686184\nMo Br\n4 12\ndirect\n0.264130 0.250000 0.045921 Mo\n0.264130 0.250000 0.454077 Mo\n0.735869 0.750000 0.545921 Mo\n0.735869 0.750000 0.954077 Mo\n0.093359 0.076998 0.250000 Br\n0.606796 0.250000 0.250000 Br\n0.093359 0.423001 0.250000 Br\n0.584426 0.597335 0.250000 Br\n0.039742 0.750000 0.250000 Br\n0.584426 0.902664 0.250000 Br\n0.415575 0.097336 0.750001 Br\n0.960259 0.250000 0.750001 Br\n0.415575 0.402664 0.750001 Br\n0.906642 0.576999 0.750001 Br\n0.393205 0.750000 0.750001 Br\n0.906642 0.923002 0.750001 Br\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Mo",
"Br"
],
"chemical_system": "Br-Mo",
"density": 4.977445347388265,
"density_atomic": 0.035721373943891785,
"volume": 447.9111028912688,
"volume_molar": 16.8586481848629,
"formula_full": "Mo4 Br12",
"formula_reduced": "MoBr3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.29076455375,
"spacegroup": 59
},
{
"id": "jvasp-60661",
"created_at": "2022-09-04T14:36:32.050074Z",
"updated_at": "2022-09-04T14:36:32.050103Z",
"structure_string": "Mo12 Br24\n1.0\n9.435575 0.060072 0.000000\n-2.045082 9.211478 0.000000\n0.000000 0.000000 11.864562\nMo Br\n12 24\ndirect\n0.127314 0.872686 0.000000 Mo\n0.065582 0.065582 0.857031 Mo\n0.434417 0.434418 0.357031 Mo\n0.934417 0.934418 0.142969 Mo\n0.856855 0.856855 0.934681 Mo\n0.565582 0.565582 0.642968 Mo\n0.356855 0.356855 0.565319 Mo\n0.143145 0.143145 0.065319 Mo\n0.627313 0.372686 0.500000 Mo\n0.872686 0.127314 0.000000 Mo\n0.643144 0.643145 0.434681 Mo\n0.372686 0.627314 0.500000 Mo\n0.547936 0.296171 0.707880 Br\n0.918640 0.665539 0.077841 Br\n0.581360 0.834461 0.577841 Br\n0.165539 0.418640 0.422159 Br\n0.334461 0.081360 0.922159 Br\n0.952063 0.203828 0.207880 Br\n0.646100 0.646101 0.853849 Br\n0.047937 0.796172 0.792119 Br\n0.853899 0.853899 0.353849 Br\n0.146101 0.146101 0.646151 Br\n0.353899 0.353899 0.146151 Br\n0.801816 0.198183 0.500000 Br\n0.698183 0.301816 0.000000 Br\n0.198184 0.801817 0.500000 Br\n0.796171 0.047936 0.792119 Br\n0.301816 0.698184 0.000000 Br\n0.418640 0.165539 0.422159 Br\n0.834461 0.581360 0.577841 Br\n0.665539 0.918640 0.077841 Br\n0.203828 0.952064 0.207880 Br\n0.296171 0.547937 0.707880 Br\n0.452063 0.703829 0.292119 Br\n0.081360 0.334461 0.922159 Br\n0.703828 0.452063 0.292119 Br\n",
"nsites": 36,
"nelements": 2,
"elements": [
"Mo",
"Br"
],
"chemical_system": "Br-Mo",
"density": 4.9349159754875265,
"density_atomic": 0.03486098658065216,
"volume": 1032.6730116117824,
"volume_molar": 17.274728430497966,
"formula_full": "Mo12 Br24",
"formula_reduced": "MoBr2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.495658036666667,
"spacegroup": 64
},
{
"id": "jvasp-99861",
"created_at": "2022-09-04T14:36:31.844905Z",
"updated_at": "2022-09-04T14:36:31.844934Z",
"structure_string": "Mo2 Br6\n1.0\n6.606692 0.000000 0.000000\n-3.303347 5.721563 0.000000\n0.000000 -0.000000 5.995121\nMo Br\n2 6\ndirect\n0.000000 0.000000 0.500000 Mo\n0.000000 0.000000 0.000000 Mo\n-0.000000 0.320230 0.250000 Br\n0.679770 0.679770 0.250000 Br\n-0.000001 0.679770 0.750000 Br\n0.320229 0.320230 0.750000 Br\n0.679770 -0.000000 0.750000 Br\n0.320230 -0.000000 0.250000 Br\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mo",
"Br"
],
"chemical_system": "Br-Mo",
"density": 4.918941237764998,
"density_atomic": 0.03530151053379854,
"volume": 226.61919784822246,
"volume_molar": 17.05915885450356,
"formula_full": "Mo2 Br6",
"formula_reduced": "MoBr3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.29250955375,
"spacegroup": 193
},
{
"id": "jvasp-4258",
"created_at": "2022-09-04T14:37:33.815822Z",
"updated_at": "2022-09-04T14:37:33.815846Z",
"structure_string": "Mo4 Br12\n1.0\n6.074176 0.000000 0.000000\n0.000000 6.592487 0.000000\n0.000000 0.000000 11.406921\nMo Br\n4 12\ndirect\n0.728580 0.256358 0.500000 Mo\n0.228580 0.743642 0.000000 Mo\n0.271421 0.256358 0.500000 Mo\n0.771421 0.743642 0.000000 Mo\n0.500000 0.092765 0.663940 Br\n0.000000 0.907236 0.836060 Br\n0.500000 0.092765 0.336060 Br\n0.000000 0.907236 0.163940 Br\n0.000000 0.416367 0.000000 Br\n0.500000 0.583634 0.500000 Br\n0.500000 0.053507 0.000000 Br\n0.000000 0.946494 0.500000 Br\n0.000000 0.411152 0.345047 Br\n0.500000 0.588849 0.154953 Br\n0.000000 0.411152 0.654953 Br\n0.500000 0.588849 0.845047 Br\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Mo",
"Br"
],
"chemical_system": "Br-Mo",
"density": 4.880825047670257,
"density_atomic": 0.03502796404867136,
"volume": 456.77790401314786,
"volume_molar": 17.192380212655905,
"formula_full": "Mo4 Br12",
"formula_reduced": "MoBr3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.28975455375,
"spacegroup": 59
},
{
"id": "jvasp-118751",
"created_at": "2022-09-04T14:38:47.290352Z",
"updated_at": "2022-09-04T14:38:47.290371Z",
"structure_string": "Mo2 Br2\n1.0\n4.595087 -0.390095 0.096238\n-1.709396 -3.138946 0.012800\n-0.443052 3.233339 -7.222891\nMo Br\n2 2\ndirect\n0.877457 -0.037729 0.844405 Mo\n0.533235 0.284844 0.844240 Mo\n0.051760 0.815824 0.537695 Br\n0.358949 0.431350 0.150960 Br\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mo",
"Br"
],
"chemical_system": "Br-Mo",
"density": 5.400143485672216,
"density_atomic": 0.036987812158678704,
"volume": 108.14373077379902,
"volume_molar": 16.281419225784035,
"formula_full": "Mo2 Br2",
"formula_reduced": "MoBr",
"formula_anonymous": "AB",
"energy_above_hull": 2.0129900025,
"spacegroup": 12
},
{
"id": "jvasp-118749",
"created_at": "2022-09-04T14:38:47.285890Z",
"updated_at": "2022-09-04T14:38:47.285918Z",
"structure_string": "Mo1 Br2\n1.0\n4.906902 -0.386595 -0.037976\n4.243017 -5.217706 -0.663394\n-1.159050 -0.550283 -3.001883\nMo Br\n1 2\ndirect\n0.083711 0.858568 0.035542 Mo\n0.752181 0.280115 0.370851 Br\n0.752273 0.768870 0.368655 Br\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Mo",
"Br"
],
"chemical_system": "Br-Mo",
"density": 6.052821971726439,
"density_atomic": 0.04275804219961136,
"volume": 70.16223956173718,
"volume_molar": 14.0842294225874,
"formula_full": "Mo1 Br2",
"formula_reduced": "MoBr2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.760468036666667,
"spacegroup": 44
},
{
"id": "jvasp-56175",
"created_at": "2022-09-04T14:38:30.208259Z",
"updated_at": "2022-09-04T14:38:30.208284Z",
"structure_string": "Mo5 As4\n1.0\n3.095891 0.000000 0.747495\n1.547946 6.727370 0.373747\n-0.030990 -0.000000 6.913203\nMo As\n5 4\ndirect\n0.948592 0.395122 0.707695 Mo\n0.000000 0.000000 0.000000 Mo\n0.343715 0.707694 0.604878 Mo\n0.656286 0.292306 0.395123 Mo\n0.051409 0.604878 0.292306 Mo\n0.673634 0.684451 0.968281 As\n0.326367 0.315549 0.031720 As\n0.358087 0.968281 0.315549 As\n0.641914 0.031719 0.684451 As\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Mo",
"As"
],
"chemical_system": "As-Mo",
"density": 8.978873102173885,
"density_atomic": 0.06243993215116358,
"volume": 144.13852946238802,
"volume_molar": 9.644694592910087,
"formula_full": "Mo5 As4",
"formula_reduced": "Mo5As4",
"formula_anonymous": "A4B5",
"energy_above_hull": 5.151464055555556,
"spacegroup": 87
},
{
"id": "jvasp-26180",
"created_at": "2022-09-04T14:38:00.098552Z",
"updated_at": "2022-09-04T14:38:00.098568Z",
"structure_string": "Mo4 As6\n1.0\n3.220460 0.000000 0.648643\n1.409852 6.690157 1.319184\n0.011252 -0.001965 8.263109\nMo As\n4 6\ndirect\n0.247894 0.876811 0.627398 Mo\n0.752104 0.123190 0.372601 Mo\n0.350123 0.433122 0.866630 Mo\n0.649875 0.566879 0.133369 Mo\n0.128337 0.790689 0.952636 As\n0.871662 0.209313 0.047363 As\n0.414357 0.857578 0.313707 As\n0.585642 0.142424 0.686292 As\n0.105590 0.418886 0.369932 As\n0.894408 0.581115 0.630067 As\n",
"nsites": 10,
"nelements": 2,
"elements": [
"Mo",
"As"
],
"chemical_system": "As-Mo",
"density": 7.774106799813193,
"density_atomic": 0.05618306702486994,
"volume": 177.989571049466,
"volume_molar": 10.718782506719052,
"formula_full": "Mo4 As6",
"formula_reduced": "Mo2As3",
"formula_anonymous": "A2B3",
"energy_above_hull": 3.98365341,
"spacegroup": 12
},
{
"id": "jvasp-19955",
"created_at": "2022-09-04T14:37:35.830741Z",
"updated_at": "2022-09-04T14:37:35.830762Z",
"structure_string": "Mo5 As4\n1.0\n3.216954 0.000000 0.778166\n1.608477 6.846620 0.389083\n-0.001262 -0.000000 7.043777\nMo As\n5 4\ndirect\n0.700608 0.919991 0.678796 Mo\n0.379403 0.321204 0.919991 Mo\n0.620598 0.678796 0.080009 Mo\n0.299393 0.080009 0.321204 Mo\n0.000000 0.000000 0.000000 Mo\n0.942806 0.771043 0.343347 As\n0.286152 0.656653 0.771043 As\n0.713848 0.343347 0.228957 As\n0.057195 0.228957 0.656653 As\n",
"nsites": 9,
"nelements": 2,
"elements": [
"Mo",
"As"
],
"chemical_system": "As-Mo",
"density": 8.341735704562241,
"density_atomic": 0.05800921847193715,
"volume": 155.14775473753173,
"volume_molar": 10.381351306970808,
"formula_full": "Mo5 As4",
"formula_reduced": "Mo5As4",
"formula_anonymous": "A4B5",
"energy_above_hull": 5.129262944444445,
"spacegroup": 87
},
{
"id": "jvasp-16234",
"created_at": "2022-09-04T14:37:07.276474Z",
"updated_at": "2022-09-04T14:37:07.276511Z",
"structure_string": "Mo4 As4\n1.0\n3.401711 0.000000 0.000000\n0.000000 6.129636 0.000000\n0.000000 0.000000 6.393821\nMo As\n4 4\ndirect\n0.250000 0.514462 0.682575 Mo\n0.750000 0.485538 0.317425 Mo\n0.250000 0.014462 0.817425 Mo\n0.750000 0.985538 0.182575 Mo\n0.250000 0.691664 0.070238 As\n0.750000 0.308336 0.929762 As\n0.250000 0.191664 0.429762 As\n0.750000 0.808337 0.570238 As\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mo",
"As"
],
"chemical_system": "As-Mo",
"density": 8.512575647605171,
"density_atomic": 0.06000637802495378,
"volume": 133.31916145102414,
"volume_molar": 10.035834453290414,
"formula_full": "Mo4 As4",
"formula_reduced": "MoAs",
"formula_anonymous": "AB",
"energy_above_hull": 2.670513825,
"spacegroup": 62
}
]
}