HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 146323,
"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-chemical_system&page=150",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-chemical_system&page=148",
"results": [
{
"id": "mp-1023933",
"created_at": "2022-09-04T14:43:22.542122Z",
"structure_string": "W2 Se4\n1.0\n1.663535 -2.881326 0.000000\n1.663535 2.881326 0.000000\n0.000000 0.000000 25.068951\nW Se\n2 4\ndirect\n0.666667 0.333333 0.150275 W\n0.333333 0.666667 0.849725 W\n0.333333 0.666667 0.217339 Se\n0.666667 0.333333 0.916789 Se\n0.333333 0.666667 0.083211 Se\n0.666667 0.333333 0.782661 Se\n",
"nsites": 6,
"nelements": 2,
"elements": [
"W",
"Se"
],
"chemical_system": "Se-W",
"density": 4.72291170171734,
"density_atomic": 0.024966677558481313,
"volume": 240.3203223955511,
"volume_molar": 24.120713482576488,
"formula_full": "W2 Se4",
"formula_reduced": "WSe2",
"formula_anonymous": "AB2",
"energy": -45.1301212,
"energy_per_atom": -7.521686866666666,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -43.2421212,
"band_gap": 1.5241,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0001538,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:09.335000Z",
"spacegroup": 164
},
{
"id": "mp-1028698",
"created_at": "2022-09-04T14:42:56.130022Z",
"structure_string": "W4 Se8\n1.0\n1.663535 -2.881326 0.000000\n1.663535 2.881326 0.000000\n0.000000 0.000000 40.137901\nW Se\n4 8\ndirect\n0.666667 0.333333 0.906142 W\n0.666667 0.333333 0.281573 W\n0.333333 0.666667 0.718427 W\n0.333333 0.666667 0.093858 W\n0.333333 0.666667 0.948029 Se\n0.333333 0.666667 0.323458 Se\n0.666667 0.333333 0.760315 Se\n0.666667 0.333333 0.135744 Se\n0.333333 0.666667 0.864256 Se\n0.333333 0.666667 0.239685 Se\n0.666667 0.333333 0.676542 Se\n0.666667 0.333333 0.051971 Se\n",
"nsites": 12,
"nelements": 2,
"elements": [
"W",
"Se"
],
"chemical_system": "Se-W",
"density": 5.899583141015699,
"density_atomic": 0.031186903188902063,
"volume": 384.77690225652896,
"volume_molar": 19.309838888213157,
"formula_full": "W4 Se8",
"formula_reduced": "WSe2",
"formula_anonymous": "AB2",
"energy": -90.2644638,
"energy_per_atom": -7.52203865,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -86.4884638,
"band_gap": 2.0995,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 1.63e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:53.948000Z",
"spacegroup": 164
},
{
"id": "mp-1025572",
"created_at": "2022-09-04T14:41:25.559097Z",
"structure_string": "W3 Se6\n1.0\n1.663041 -2.880472 0.000000\n1.663041 2.880472 0.000000\n0.000000 0.000000 32.590385\nW Se\n3 6\ndirect\n0.666667 0.333333 0.000000 W\n0.333333 0.666667 0.768902 W\n0.333333 0.666667 0.231098 W\n0.333333 0.666667 0.051562 Se\n0.666667 0.333333 0.820474 Se\n0.666667 0.333333 0.282658 Se\n0.333333 0.666667 0.948438 Se\n0.666667 0.333333 0.717342 Se\n0.666667 0.333333 0.179526 Se\n",
"nsites": 9,
"nelements": 2,
"elements": [
"W",
"Se"
],
"chemical_system": "Se-W",
"density": 5.452623140323926,
"density_atomic": 0.028824143323043803,
"volume": 312.23824760838056,
"volume_molar": 20.892696419482235,
"formula_full": "W3 Se6",
"formula_reduced": "WSe2",
"formula_anonymous": "AB2",
"energy": -67.69743471,
"energy_per_atom": -7.521937189999999,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -64.86543471,
"band_gap": 1.5137999999999998,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 4.21e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:19.863000Z",
"spacegroup": 187
},
{
"id": "mp-685047",
"created_at": "2022-09-04T14:48:29.114354Z",
"structure_string": "V23 Se40\n1.0\n1.710335 12.423343 0.000000\n-1.710335 12.423343 0.000000\n0.000000 7.257712 29.829671\nV Se\n23 40\ndirect\n0.876625 0.876625 0.735589 V\n0.624904 0.624904 0.772475 V\n0.376889 0.376889 0.615041 V\n0.123384 0.123384 0.685686 V\n0.250579 0.250579 0.650575 V\n0.875787 0.875787 0.525977 V\n0.623942 0.623942 0.566409 V\n0.876616 0.876616 0.314314 V\n0.124213 0.124213 0.474023 V\n0.623111 0.623111 0.384959 V\n0.376058 0.376058 0.433591 V\n0.375096 0.375096 0.227525 V\n0.749421 0.749421 0.349425 V\n0.123375 0.123375 0.264411 V\n0.625069 0.625069 0.174680 V\n0.372571 0.372571 0.034967 V\n0.874800 0.874800 0.122937 V\n0.126654 0.126654 0.084525 V\n0.873346 0.873346 0.915475 V\n0.125200 0.125200 0.877063 V\n0.500000 0.500000 0.000000 V\n0.627429 0.627429 0.965033 V\n0.374931 0.374931 0.825320 V\n0.063974 0.063974 0.820245 Se\n0.310084 0.310084 0.772699 Se\n0.193671 0.193671 0.731665 Se\n0.941957 0.941957 0.781813 Se\n0.682464 0.682464 0.630551 Se\n0.556673 0.556673 0.723183 Se\n0.429066 0.429066 0.681229 Se\n0.818085 0.818085 0.671051 Se\n0.942472 0.942472 0.576859 Se\n0.189835 0.189835 0.528130 Se\n0.308378 0.308378 0.568921 Se\n0.071070 0.071070 0.620884 Se\n0.810165 0.810165 0.471870 Se\n0.440751 0.440751 0.481069 Se\n0.691622 0.691622 0.431079 Se\n0.559249 0.559249 0.518931 Se\n0.181915 0.181915 0.328949 Se\n0.928930 0.928930 0.379116 Se\n0.317536 0.317536 0.369449 Se\n0.057528 0.057528 0.423141 Se\n0.806329 0.806329 0.268335 Se\n0.570934 0.570934 0.318771 Se\n0.443327 0.443327 0.276817 Se\n0.689916 0.689916 0.227301 Se\n0.058043 0.058043 0.218187 Se\n0.313746 0.313746 0.169668 Se\n0.936026 0.936026 0.179755 Se\n0.192045 0.192045 0.130418 Se\n0.560431 0.560431 0.121692 Se\n0.806570 0.806570 0.072156 Se\n0.442988 0.442988 0.080623 Se\n0.678785 0.678785 0.030316 Se\n0.067635 0.067635 0.020712 Se\n0.321215 0.321215 0.969684 Se\n0.193430 0.193430 0.927844 Se\n0.932365 0.932365 0.979288 Se\n0.557012 0.557012 0.919377 Se\n0.807955 0.807955 0.869582 Se\n0.439569 0.439569 0.878308 Se\n0.686254 0.686254 0.830332 Se\n",
"nsites": 63,
"nelements": 2,
"elements": [
"V",
"Se"
],
"chemical_system": "Se-V",
"density": 5.67210604646895,
"density_atomic": 0.049698402753247356,
"volume": 1267.646373119778,
"volume_molar": 12.117372845763148,
"formula_full": "V23 Se40",
"formula_reduced": "V23Se40",
"formula_anonymous": "A23B40",
"energy": -410.11288051,
"energy_per_atom": -6.509728262063493,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -391.23288051,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 18.9154049,
"is_theoretical": true,
"updated_at": "2021-11-28T01:39:24.260000Z",
"spacegroup": 12
},
{
"id": "mp-694",
"created_at": "2022-09-04T14:48:30.988195Z",
"structure_string": "V1 Se2\n1.0\n1.676903 -2.904481 0.000000\n1.676903 2.904481 0.000000\n0.000000 0.000000 7.000427\nV Se\n1 2\ndirect\n0.000000 0.000000 0.000000 V\n0.666667 0.333333 0.774935 Se\n0.333333 0.666667 0.225065 Se\n",
"nsites": 3,
"nelements": 2,
"elements": [
"V",
"Se"
],
"chemical_system": "Se-V",
"density": 5.08600147515682,
"density_atomic": 0.04399367542540862,
"volume": 68.1916200679006,
"volume_molar": 13.688651156711272,
"formula_full": "V1 Se2",
"formula_reduced": "VSe2",
"formula_anonymous": "AB2",
"energy": -19.09464572,
"energy_per_atom": -6.364881906666667,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -18.15064572,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.7305515,
"is_theoretical": false,
"updated_at": "2021-11-28T01:39:54.883000Z",
"spacegroup": 164
},
{
"id": "mp-1207893",
"created_at": "2022-09-04T14:42:18.301224Z",
"structure_string": "V5 Se8\n1.0\n3.575951 5.904882 0.000000\n-3.575951 5.904882 0.000000\n0.000000 5.797891 6.054117\nV Se\n5 8\ndirect\n0.000000 0.000000 0.000000 V\n0.729172 0.729172 0.043546 V\n0.270828 0.270828 0.956454 V\n0.711507 0.288493 0.500000 V\n0.288493 0.711507 0.500000 V\n0.537238 0.045417 0.169934 Se\n0.462762 0.954583 0.830066 Se\n0.954583 0.462762 0.830066 Se\n0.045417 0.537238 0.169934 Se\n0.982152 0.982152 0.322309 Se\n0.017848 0.017848 0.677691 Se\n0.442418 0.442418 0.334461 Se\n0.557582 0.557582 0.665539 Se\n",
"nsites": 13,
"nelements": 2,
"elements": [
"V",
"Se"
],
"chemical_system": "Se-V",
"density": 5.756905923346493,
"density_atomic": 0.05084634786906013,
"volume": 255.67224677527855,
"volume_molar": 11.843801988509103,
"formula_full": "V5 Se8",
"formula_reduced": "V5Se8",
"formula_anonymous": "A5B8",
"energy": -86.46795621999999,
"energy_per_atom": -6.651381247692307,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -82.69195622,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 7.0005543,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:44.108000Z",
"spacegroup": 12
},
{
"id": "mp-569668",
"created_at": "2022-09-04T14:42:21.489562Z",
"structure_string": "V2 Se2\n1.0\n1.736937 -3.008463 0.000000\n1.736937 3.008463 0.000000\n0.000000 0.000000 6.806614\nV Se\n2 2\ndirect\n0.333333 0.666667 0.250000 V\n0.666667 0.333333 0.750000 V\n0.000000 0.000000 0.000000 Se\n0.000000 0.000000 0.500000 Se\n",
"nsites": 4,
"nelements": 2,
"elements": [
"V",
"Se"
],
"chemical_system": "Se-V",
"density": 6.064617288216195,
"density_atomic": 0.05623026520523417,
"volume": 71.13606854601251,
"volume_molar": 10.709785447427397,
"formula_full": "V2 Se2",
"formula_reduced": "VSe",
"formula_anonymous": "AB",
"energy": -27.02872276,
"energy_per_atom": -6.75718069,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -26.08472276,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 4.814195,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:46.539000Z",
"spacegroup": 194
},
{
"id": "mp-28256",
"created_at": "2022-09-04T14:39:59.068680Z",
"structure_string": "V4 Se18\n1.0\n6.688082 5.466583 0.000000\n-6.688082 5.466583 0.000000\n0.000000 1.441072 8.402840\nV Se\n4 18\ndirect\n0.400382 0.863917 0.085174 V\n0.136083 0.599618 0.414826 V\n0.599618 0.136083 0.914826 V\n0.863917 0.400382 0.585174 V\n0.393843 0.698693 0.528460 Se\n0.301307 0.606157 0.971540 Se\n0.704804 0.101547 0.620531 Se\n0.898453 0.295196 0.879469 Se\n0.295196 0.898453 0.379469 Se\n0.101547 0.704804 0.120531 Se\n0.138635 0.327691 0.556864 Se\n0.672309 0.861365 0.943136 Se\n0.861365 0.672309 0.443136 Se\n0.327691 0.138635 0.056864 Se\n0.006276 0.333813 0.334952 Se\n0.666187 0.993724 0.165048 Se\n0.993724 0.666187 0.665048 Se\n0.333813 0.006276 0.834952 Se\n0.698693 0.393843 0.028460 Se\n0.606157 0.301307 0.471540 Se\n0.406059 0.593941 0.250000 Se\n0.593941 0.406059 0.750000 Se\n",
"nsites": 22,
"nelements": 2,
"elements": [
"V",
"Se"
],
"chemical_system": "Se-V",
"density": 4.391785606548755,
"density_atomic": 0.035805443330798346,
"volume": 614.4317163384071,
"volume_molar": 16.81906492362854,
"formula_full": "V4 Se18",
"formula_reduced": "V2Se9",
"formula_anonymous": "A2B9",
"energy": -116.76624142,
"energy_per_atom": -5.307556428181818,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -108.27024142,
"band_gap": 0.722,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0009559,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:55.452000Z",
"spacegroup": 15
},
{
"id": "mp-604914",
"created_at": "2022-09-04T14:43:21.312202Z",
"structure_string": "V2 Se2\n1.0\n3.629030 0.000000 0.000000\n0.000000 3.629030 0.000000\n0.000000 0.000000 6.572222\nV Se\n2 2\ndirect\n0.500000 0.500000 0.000000 V\n0.000000 0.000000 0.000000 V\n0.000000 0.500000 0.737628 Se\n0.500000 0.000000 0.262372 Se\n",
"nsites": 4,
"nelements": 2,
"elements": [
"V",
"Se"
],
"chemical_system": "Se-V",
"density": 4.984251147331247,
"density_atomic": 0.0462132646702203,
"volume": 86.5552353538353,
"volume_molar": 13.031195270393114,
"formula_full": "V2 Se2",
"formula_reduced": "VSe",
"formula_anonymous": "AB",
"energy": -28.31658243,
"energy_per_atom": -7.0791456075,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -27.37258243,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0759687,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:15.369000Z",
"spacegroup": 129
},
{
"id": "mp-29131",
"created_at": "2022-09-04T14:47:23.575035Z",
"structure_string": "V2 Se2\n1.0\n1.885118 -3.265120 0.000000\n1.885118 3.265120 0.000000\n0.000000 0.000000 5.784370\nV Se\n2 2\ndirect\n0.000000 0.000000 0.000000 V\n0.000000 0.000000 0.500000 V\n0.333333 0.666667 0.250000 Se\n0.666667 0.333333 0.750000 Se\n",
"nsites": 4,
"nelements": 2,
"elements": [
"V",
"Se"
],
"chemical_system": "Se-V",
"density": 6.058561364081423,
"density_atomic": 0.05617411554170591,
"volume": 71.20717364976116,
"volume_molar": 10.720490571015615,
"formula_full": "V2 Se2",
"formula_reduced": "VSe",
"formula_anonymous": "AB",
"energy": -28.11379257,
"energy_per_atom": -7.0284481425,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -27.16979257,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 4.2852306,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:06.439000Z",
"spacegroup": 194
},
{
"id": "mp-1087497",
"created_at": "2022-09-04T14:39:33.032762Z",
"structure_string": "V5 Se4\n1.0\n-4.664095 4.664095 1.663509\n4.664095 -4.664095 1.663509\n4.664095 4.664095 -1.663509\nV Se\n5 4\ndirect\n0.000000 0.000000 0.000000 V\n0.380216 0.306748 0.686964 V\n0.619784 0.693252 0.313036 V\n0.693252 0.380216 0.073469 V\n0.306748 0.619784 0.926531 V\n0.277096 0.062044 0.339140 Se\n0.722904 0.937956 0.660860 Se\n0.937956 0.277096 0.215052 Se\n0.062044 0.722904 0.784948 Se\n",
"nsites": 9,
"nelements": 2,
"elements": [
"V",
"Se"
],
"chemical_system": "Se-V",
"density": 6.5451707758938955,
"density_atomic": 0.06217597264358093,
"volume": 144.7504496888504,
"volume_molar": 9.68563981221728,
"formula_full": "V5 Se4",
"formula_reduced": "V5Se4",
"formula_anonymous": "A4B5",
"energy": -67.00911519,
"energy_per_atom": -7.445457243333333,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -65.12111519,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 0.2667671,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:29.520000Z",
"spacegroup": 87
},
{
"id": "mp-22700",
"created_at": "2022-09-04T14:41:01.804743Z",
"structure_string": "V3 Se4\n1.0\n1.702433 6.681736 0.000000\n-1.702433 6.681736 0.000000\n0.000000 2.706975 5.562788\nV Se\n3 4\ndirect\n0.744760 0.744760 0.323173 V\n0.255240 0.255240 0.676827 V\n0.000000 0.000000 0.000000 V\n0.358765 0.358765 0.979851 Se\n0.641235 0.641235 0.020149 Se\n0.892789 0.892789 0.452422 Se\n0.107211 0.107211 0.547578 Se\n",
"nsites": 7,
"nelements": 2,
"elements": [
"V",
"Se"
],
"chemical_system": "Se-V",
"density": 6.149351375277473,
"density_atomic": 0.055311596470807294,
"volume": 126.5557396032585,
"volume_molar": 10.887663969667562,
"formula_full": "V3 Se4",
"formula_reduced": "V3Se4",
"formula_anonymous": "A3B4",
"energy": -48.21626601,
"energy_per_atom": -6.888038001428571,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -46.32826601,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 1.9497014,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:09.836000Z",
"spacegroup": 12
}
]
}