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=-structure_string&page=839",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-structure_string&page=837",
"results": [
{
"id": "jvasp-20079",
"created_at": "2022-09-04T14:36:42.577830Z",
"updated_at": "2022-09-04T14:36:42.577849Z",
"structure_string": "Ta2 B2\n1.0\n3.164354 -0.000000 -0.000000\n0.000000 3.089796 -1.167629\n0.000000 -0.001345 4.668388\nTa B\n2 2\ndirect\n0.749999 0.145991 0.291981 Ta\n0.250000 0.854012 0.708020 Ta\n0.749999 0.440882 0.881762 B\n0.250000 0.559120 0.118239 B\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ta",
"B"
],
"chemical_system": "B-Ta",
"density": 13.954042808762209,
"density_atomic": 0.08764466083080154,
"volume": 45.63883255503744,
"volume_molar": 6.871086844212648,
"formula_full": "Ta2 B2",
"formula_reduced": "TaB",
"formula_anonymous": "AB",
"energy_above_hull": 3.3423508916666664,
"spacegroup": 63
},
{
"id": "jvasp-75558",
"created_at": "2022-09-04T14:35:55.744828Z",
"updated_at": "2022-09-04T14:35:55.744856Z",
"structure_string": "Ta2 B1 As1\n1.0\n-0.000000 3.153838 3.153838\n3.153838 0.000000 3.153838\n3.153838 3.153838 -0.000000\nTa B As\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ta\n0.250000 0.250000 0.250000 Ta\n0.750000 0.750000 0.750000 B\n0.500000 0.500000 0.500000 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"B",
"As"
],
"chemical_system": "As-B-Ta",
"density": 11.84727722290296,
"density_atomic": 0.06375464779194881,
"volume": 62.74052384468095,
"volume_molar": 9.445806648720128,
"formula_full": "Ta2 B1 As1",
"formula_reduced": "Ta2BAs",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.264393183333333,
"spacegroup": 216
},
{
"id": "jvasp-16771",
"created_at": "2022-09-04T14:37:27.704432Z",
"updated_at": "2022-09-04T14:37:27.704458Z",
"structure_string": "Ta2 As4\n1.0\n3.335614 -0.000000 0.831797\n1.528678 4.701445 0.973823\n0.009023 0.003692 7.067840\nTa As\n2 4\ndirect\n0.157305 0.880973 0.804417 Ta\n0.842695 0.119025 0.195583 Ta\n0.859746 0.752086 0.528420 As\n0.140253 0.247913 0.471580 As\n0.406247 0.295610 0.891892 As\n0.593752 0.704389 0.108108 As\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ta",
"As"
],
"chemical_system": "As-Ta",
"density": 9.91530120609385,
"density_atomic": 0.05415321921153065,
"volume": 110.79673724590765,
"volume_molar": 11.120559124059845,
"formula_full": "Ta2 As4",
"formula_reduced": "TaAs2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.209720899999999,
"spacegroup": 12
},
{
"id": "jvasp-50460",
"created_at": "2022-09-04T14:37:35.574538Z",
"updated_at": "2022-09-04T14:37:35.574575Z",
"structure_string": "Ta2 As2 O8\n1.0\n3.916538 0.000000 0.000000\n-1.958269 7.285128 0.000000\n0.000000 0.000000 5.585774\nTa As O\n2 2 8\ndirect\n0.408472 0.816943 0.203833 Ta\n0.591528 0.183057 0.703833 Ta\n0.177008 0.354014 0.297509 As\n0.822993 0.645986 0.797509 As\n0.107259 0.214518 0.625000 O\n0.293429 0.586857 0.396502 O\n0.329621 0.659243 0.903228 O\n0.480026 0.960053 0.489125 O\n0.519974 0.039948 0.989125 O\n0.670379 0.340757 0.403228 O\n0.706571 0.413143 0.896501 O\n0.892741 0.785482 0.125000 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ta",
"As",
"O"
],
"chemical_system": "As-O-Ta",
"density": 6.665392789497237,
"density_atomic": 0.0752936506243398,
"volume": 159.37598855275613,
"volume_molar": 7.998205306907051,
"formula_full": "Ta2 As2 O8",
"formula_reduced": "TaAsO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.0812324916666665,
"spacegroup": 36
},
{
"id": "jvasp-49944",
"created_at": "2022-09-04T14:38:07.464886Z",
"updated_at": "2022-09-04T14:38:07.464897Z",
"structure_string": "Ta2 As2 O8\n1.0\n0.000000 5.092222 -0.055126\n5.542487 0.000000 0.000000\n0.000000 -1.012138 -5.522698\nTa As O\n2 2 8\ndirect\n0.504055 0.335041 0.509048 Ta\n0.504055 0.664960 0.009048 Ta\n0.048112 0.187767 0.932393 As\n0.048112 0.812233 0.432392 As\n0.791570 0.867210 0.161722 O\n0.661478 0.396006 0.226405 O\n0.264297 0.606556 0.287776 O\n0.258627 0.077349 0.397609 O\n0.791570 0.132791 0.661723 O\n0.661478 0.603995 0.726405 O\n0.264297 0.393445 0.787776 O\n0.258627 0.922651 0.897609 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ta",
"As",
"O"
],
"chemical_system": "As-O-Ta",
"density": 6.8018108909912245,
"density_atomic": 0.07683465761329158,
"volume": 156.17952071050976,
"volume_molar": 7.837792146233542,
"formula_full": "Ta2 As2 O8",
"formula_reduced": "TaAsO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.0746441583333333,
"spacegroup": 7
},
{
"id": "jvasp-20518",
"created_at": "2022-09-04T14:37:48.897775Z",
"updated_at": "2022-09-04T14:37:48.897803Z",
"structure_string": "Ta2 As2\n1.0\n3.338419 -0.000000 -0.945035\n-0.267520 3.327684 -0.945035\n0.002227 0.002413 6.377013\nTa As\n2 2\ndirect\n0.000006 0.000006 0.000014 Ta\n0.750007 0.250006 0.500013 Ta\n0.417695 0.417693 0.835385 As\n0.167694 0.667693 0.335386 As\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ta",
"As"
],
"chemical_system": "As-Ta",
"density": 11.99234249151574,
"density_atomic": 0.056450323462567266,
"volume": 70.85876137897486,
"volume_molar": 10.668035877585957,
"formula_full": "Ta2 As2",
"formula_reduced": "TaAs",
"formula_anonymous": "AB",
"energy_above_hull": 2.755045475,
"spacegroup": 109
},
{
"id": "jvasp-20249",
"created_at": "2022-09-04T14:37:45.355910Z",
"updated_at": "2022-09-04T14:37:45.355931Z",
"structure_string": "Ta2 As2\n1.0\n3.338419 -0.000000 -0.945035\n-0.267520 3.327684 -0.945035\n0.002227 0.002413 6.377013\nTa As\n2 2\ndirect\n0.000006 0.000006 0.000014 Ta\n0.750007 0.250006 0.500013 Ta\n0.417695 0.417693 0.835385 As\n0.167694 0.667693 0.335386 As\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ta",
"As"
],
"chemical_system": "As-Ta",
"density": 11.99234249151574,
"density_atomic": 0.056450323462567266,
"volume": 70.85876137897486,
"volume_molar": 10.668035877585957,
"formula_full": "Ta2 As2",
"formula_reduced": "TaAs",
"formula_anonymous": "AB",
"energy_above_hull": 2.755045475,
"spacegroup": 109
},
{
"id": "jvasp-11183",
"created_at": "2022-09-04T14:37:04.884167Z",
"updated_at": "2022-09-04T14:37:04.884202Z",
"structure_string": "Ta2 Al2 O8\n1.0\n3.800817 0.000000 0.000000\n-1.900409 5.830301 -1.866558\n0.000000 0.002008 6.517377\nTa Al O\n2 2 8\ndirect\n0.894505 0.789009 0.766749 Ta\n0.105495 0.210991 0.233251 Ta\n0.799532 0.599065 0.179660 Al\n0.200468 0.400936 0.820340 Al\n0.358169 0.716338 0.797154 O\n0.641832 0.283662 0.202847 O\n0.942309 0.884618 0.134740 O\n0.057691 0.115382 0.865260 O\n0.140813 0.281627 0.526060 O\n0.859187 0.718374 0.473940 O\n0.262393 0.524785 0.142173 O\n0.737607 0.475215 0.857827 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ta",
"Al",
"O"
],
"chemical_system": "Al-O-Ta",
"density": 6.252415608473665,
"density_atomic": 0.0830802185625732,
"volume": 144.43871486642766,
"volume_molar": 7.248585600992767,
"formula_full": "Ta2 Al2 O8",
"formula_reduced": "TaAlO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.808886,
"spacegroup": 12
},
{
"id": "jvasp-116644",
"created_at": "2022-09-04T14:38:44.620457Z",
"updated_at": "2022-09-04T14:38:44.620492Z",
"structure_string": "Ta2 Al2 Fe8\n1.0\n4.735707 0.000000 0.000000\n-2.367854 4.101242 0.000000\n-0.000000 -0.000000 7.656750\nTa Al Fe\n2 2 8\ndirect\n0.666667 0.333333 0.922219 Ta\n0.333334 0.666666 0.077781 Ta\n0.333334 0.666666 0.444762 Al\n0.666667 0.333333 0.555238 Al\n0.000000 0.000000 0.500000 Fe\n0.000000 0.000000 0.000000 Fe\n0.829587 0.170414 0.252318 Fe\n0.829587 0.659172 0.252318 Fe\n0.340828 0.170414 0.252318 Fe\n0.170415 0.829586 0.747682 Fe\n0.170414 0.340828 0.747682 Fe\n0.659173 0.829586 0.747682 Fe\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Ta",
"Al",
"Fe"
],
"chemical_system": "Al-Fe-Ta",
"density": 9.632152438791552,
"density_atomic": 0.0806931293313877,
"volume": 148.71154582094374,
"volume_molar": 7.463015513090942,
"formula_full": "Ta2 Al2 Fe8",
"formula_reduced": "TaAlFe4",
"formula_anonymous": "ABC4",
"energy_above_hull": 4.054259,
"spacegroup": 164
},
{
"id": "jvasp-57129",
"created_at": "2022-09-04T14:38:31.174206Z",
"updated_at": "2022-09-04T14:38:31.174231Z",
"structure_string": "Ta2 Ag2 S6\n1.0\n3.391153 0.000000 0.000000\n-1.695577 7.093320 0.000000\n0.000000 0.000000 7.803974\nTa Ag S\n2 2 6\ndirect\n0.737238 0.474478 0.509769 Ta\n0.262760 0.525522 0.009769 Ta\n0.000062 0.000125 0.759907 Ag\n-0.000062 -0.000125 0.259907 Ag\n0.673015 0.346031 0.189471 S\n0.673028 0.346057 0.830053 S\n0.326970 0.653943 0.330053 S\n0.897031 0.794066 0.009799 S\n0.102967 0.205934 0.509799 S\n0.326983 0.653968 0.689471 S\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ta",
"Ag",
"S"
],
"chemical_system": "Ag-S-Ta",
"density": 6.8114499574828,
"density_atomic": 0.05327055839254406,
"volume": 187.7209532198115,
"volume_molar": 11.3048200389108,
"formula_full": "Ta2 Ag2 S6",
"formula_reduced": "TaAgS3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.431443292,
"spacegroup": 63
},
{
"id": "jvasp-21088",
"created_at": "2022-09-04T14:37:26.899109Z",
"updated_at": "2022-09-04T14:37:26.899118Z",
"structure_string": "Ta2 Ag2 S6\n1.0\n3.391142 0.000000 -0.000000\n-1.695571 7.092860 -0.000000\n-0.000000 0.000000 7.804357\nTa Ag S\n2 2 6\ndirect\n0.262757 0.525515 0.750000 Ta\n0.737243 0.474485 0.250000 Ta\n0.000000 0.000000 0.500000 Ag\n0.000000 0.000000 0.000000 Ag\n0.673011 0.346021 0.929710 S\n0.326989 0.653979 0.070290 S\n0.326989 0.653979 0.429710 S\n0.673011 0.346021 0.570290 S\n0.897038 0.794077 0.750000 S\n0.102962 0.205923 0.250000 S\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ta",
"Ag",
"S"
],
"chemical_system": "Ag-S-Ta",
"density": 6.811579507269319,
"density_atomic": 0.05327157156734687,
"volume": 187.71738294519474,
"volume_molar": 11.30460503194786,
"formula_full": "Ta2 Ag2 S6",
"formula_reduced": "TaAgS3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.431443292,
"spacegroup": 63
},
{
"id": "jvasp-10586",
"created_at": "2022-09-04T14:37:09.730076Z",
"updated_at": "2022-09-04T14:37:09.730097Z",
"structure_string": "Ta2 Ag2 O6\n1.0\n4.838817 0.016994 2.885726\n1.647153 4.549871 2.885726\n0.024135 0.016994 5.633914\nTa Ag O\n2 2 6\ndirect\n0.000307 0.000307 0.000307 Ta\n0.500307 0.500306 0.500308 Ta\n0.250373 0.250372 0.250373 Ag\n0.750372 0.750371 0.750374 Ag\n0.314479 0.750556 0.186486 O\n0.750557 0.186484 0.314480 O\n0.186484 0.314478 0.750557 O\n0.686484 0.250555 0.814480 O\n0.814479 0.686483 0.250558 O\n0.250556 0.814478 0.686486 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ta",
"Ag",
"O"
],
"chemical_system": "Ag-O-Ta",
"density": 9.064258830649473,
"density_atomic": 0.08103314767727184,
"volume": 123.4062884959953,
"volume_molar": 7.431700399920524,
"formula_full": "Ta2 Ag2 O6",
"formula_reduced": "TaAgO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.475155392,
"spacegroup": 167
}
]
}