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=3652",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=3650",
"results": [
{
"id": "jvasp-119620",
"created_at": "2022-09-04T14:38:51.961663Z",
"updated_at": "2022-09-04T14:38:51.961703Z",
"structure_string": "La6 Zn4 Pd13\n1.0\n7.970200 -0.000000 -2.817891\n-3.985100 6.902396 -2.817891\n-0.000000 -0.000000 8.453674\nLa Zn Pd\n6 4 13\ndirect\n0.695905 0.695905 0.000000 La\n0.304095 0.000000 0.304095 La\n0.000000 0.304096 0.304095 La\n0.304096 0.304096 0.000000 La\n0.695905 0.000000 0.695904 La\n0.000000 0.695905 0.695905 La\n0.000000 0.000000 0.500000 Zn\n0.000000 0.500000 0.000000 Zn\n0.500000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Zn\n0.671295 0.342589 0.671295 Pd\n0.671295 0.671296 0.342590 Pd\n0.657411 0.328705 0.328705 Pd\n0.328705 0.000000 0.671295 Pd\n0.328705 0.671296 0.000000 Pd\n0.671295 0.000000 0.328705 Pd\n0.328705 0.657411 0.328705 Pd\n0.671295 0.328705 0.000000 Pd\n0.000000 0.671296 0.328705 Pd\n0.342589 0.671296 0.671295 Pd\n0.328705 0.328705 0.657411 Pd\n0.000000 0.328705 0.671295 Pd\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 23,
"nelements": 3,
"elements": [
"La",
"Zn",
"Pd"
],
"chemical_system": "La-Pd-Zn",
"density": 8.849698670367383,
"density_atomic": 0.0494553464657294,
"volume": 465.0659967762655,
"volume_molar": 12.17692563163642,
"formula_full": "La6 Zn4 Pd13",
"formula_reduced": "La6Zn4Pd13",
"formula_anonymous": "A4B6C13",
"energy_above_hull": 1.4377124217391306,
"spacegroup": 229
},
{
"id": "jvasp-109976",
"created_at": "2022-09-04T14:38:07.994422Z",
"updated_at": "2022-09-04T14:38:07.994447Z",
"structure_string": "La1 Pm1 Ru2\n1.0\n4.309964 -0.000000 2.488359\n1.436655 4.063473 2.488359\n-0.000000 -0.000000 4.976718\nLa Pm Ru\n1 1 2\ndirect\n0.499999 0.500000 0.500001 La\n0.000000 0.000000 0.000000 Pm\n0.250000 0.250000 0.250001 Ru\n0.749999 0.749999 0.750002 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Pm",
"Ru"
],
"chemical_system": "La-Pm-Ru",
"density": 9.260020403405193,
"density_atomic": 0.045892946048071835,
"volume": 87.15936422582436,
"volume_molar": 13.122148998000569,
"formula_full": "La1 Pm1 Ru2",
"formula_reduced": "LaPmRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.07010429375,
"spacegroup": 225
},
{
"id": "jvasp-109980",
"created_at": "2022-09-04T14:38:18.754400Z",
"updated_at": "2022-09-04T14:38:18.754427Z",
"structure_string": "La1 Pm1 Tl2\n1.0\n4.800022 -0.000000 2.771294\n1.600007 4.525504 2.771294\n-0.000000 -0.000000 5.542588\nLa Pm Tl\n1 1 2\ndirect\n0.500000 0.500000 0.500000 La\n0.000000 0.000000 0.000000 Pm\n0.750000 0.749999 0.749999 Tl\n0.250000 0.250000 0.250000 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Pm",
"Tl"
],
"chemical_system": "La-Pm-Tl",
"density": 9.553312750421425,
"density_atomic": 0.03322287507693052,
"volume": 120.39897181498122,
"volume_molar": 18.12648889072724,
"formula_full": "La1 Pm1 Tl2",
"formula_reduced": "LaPmTl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4338953437499999,
"spacegroup": 225
},
{
"id": "jvasp-109284",
"created_at": "2022-09-04T14:37:56.328378Z",
"updated_at": "2022-09-04T14:37:56.328399Z",
"structure_string": "La1 Pm1 Zn2\n1.0\n4.528925 -0.000000 2.614776\n1.509642 4.269911 2.614776\n-0.000000 -0.000000 5.229552\nLa Pm Zn\n1 1 2\ndirect\n0.499999 0.500000 0.500001 La\n0.000000 0.000000 0.000000 Pm\n0.749999 0.750000 0.750002 Zn\n0.250000 0.250000 0.250001 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Pm",
"Zn"
],
"chemical_system": "La-Pm-Zn",
"density": 6.809720291888803,
"density_atomic": 0.039553193503280175,
"volume": 101.12963444198955,
"volume_molar": 15.225422340425128,
"formula_full": "La1 Pm1 Zn2",
"formula_reduced": "LaPmZn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-108709",
"created_at": "2022-09-04T14:38:20.532787Z",
"updated_at": "2022-09-04T14:38:20.532803Z",
"structure_string": "La1 P2 Pd2\n1.0\n3.940294 -0.012311 -4.294480\n-0.605993 3.893435 -4.294480\n0.010577 0.012311 5.828238\nLa P Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 La\n0.386325 0.386325 0.000000 P\n0.613675 0.613676 0.000001 P\n0.750000 0.250000 0.500000 Pd\n0.250001 0.750001 0.500001 Pd\n",
"nsites": 5,
"nelements": 3,
"elements": [
"La",
"P",
"Pd"
],
"chemical_system": "La-P-Pd",
"density": 7.650930108838515,
"density_atomic": 0.055687404360865465,
"volume": 89.78691065575627,
"volume_molar": 10.814188287490165,
"formula_full": "La1 P2 Pd2",
"formula_reduced": "La(PPd)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.1756954800000003,
"spacegroup": 139
},
{
"id": "jvasp-86451",
"created_at": "2022-09-04T14:36:13.573069Z",
"updated_at": "2022-09-04T14:36:13.573097Z",
"structure_string": "La2 P2 Pd2\n1.0\n4.292607 0.000000 0.000000\n-2.146303 3.717506 0.000000\n0.000000 -0.000000 8.004847\nLa P Pd\n2 2 2\ndirect\n0.000000 0.000000 0.500000 La\n0.000000 0.000000 0.000000 La\n0.666668 0.333333 0.750000 P\n0.333334 0.666668 0.250000 P\n0.333334 0.666668 0.750000 Pd\n0.666668 0.333333 0.250000 Pd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"La",
"P",
"Pd"
],
"chemical_system": "La-P-Pd",
"density": 7.183447594902083,
"density_atomic": 0.04697052423243808,
"volume": 127.73968564430817,
"volume_molar": 12.821106126469585,
"formula_full": "La2 P2 Pd2",
"formula_reduced": "LaPPd",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4828220666666665,
"spacegroup": 194
},
{
"id": "jvasp-99061",
"created_at": "2022-09-04T14:35:52.708155Z",
"updated_at": "2022-09-04T14:35:52.708173Z",
"structure_string": "La6 P17 Pd6\n1.0\n8.576026 0.000000 -3.032083\n-4.288012 7.427056 -3.032083\n0.000000 0.000000 9.096249\nLa P Pd\n6 17 6\ndirect\n0.000000 0.286248 0.286248 La\n0.713753 -0.000000 0.713753 La\n0.286248 -0.000000 0.286248 La\n0.286248 0.286248 0.000000 La\n0.713753 0.713753 0.000001 La\n0.000000 0.713753 0.713753 La\n0.000000 0.566037 0.000000 P\n0.566037 -0.000000 0.000000 P\n0.433963 0.433963 0.433963 P\n0.218711 0.218711 0.579197 P\n0.639515 0.420803 0.639515 P\n0.420804 0.639515 0.639515 P\n0.000000 0.360486 0.781289 P\n0.360486 -0.000000 0.781289 P\n0.781289 -0.000000 0.360486 P\n0.218712 0.579197 0.218712 P\n0.781289 0.360486 0.000001 P\n0.000000 0.781289 0.360486 P\n0.000000 0.000000 0.566037 P\n0.360486 0.781289 0.000001 P\n0.639515 0.639515 0.420804 P\n0.579197 0.218711 0.218712 P\n0.000000 0.000000 0.000000 P\n0.500001 0.750000 0.250001 Pd\n0.250001 0.750000 0.500001 Pd\n0.750000 0.250000 0.500001 Pd\n0.250000 0.500000 0.750001 Pd\n0.750001 0.500000 0.250001 Pd\n0.500000 0.250000 0.750001 Pd\n",
"nsites": 29,
"nelements": 3,
"elements": [
"La",
"P",
"Pd"
],
"chemical_system": "La-P-Pd",
"density": 5.72782307110192,
"density_atomic": 0.050053317809753646,
"volume": 579.3821722313263,
"volume_molar": 12.031451706936588,
"formula_full": "La6 P17 Pd6",
"formula_reduced": "La6P17Pd6",
"formula_anonymous": "A6B6C17",
"energy_above_hull": 3.15335405862069,
"spacegroup": 217
},
{
"id": "jvasp-103612",
"created_at": "2022-09-04T14:36:41.136226Z",
"updated_at": "2022-09-04T14:36:41.136250Z",
"structure_string": "La1 Pr3\n1.0\n5.224165 -0.000000 0.000000\n0.000000 5.224165 0.000000\n-0.000000 -0.000000 5.224165\nLa Pr\n1 3\ndirect\n0.000000 0.000000 0.000000 La\n-0.000000 0.500000 0.500000 Pr\n0.500000 0.000000 0.500000 Pr\n0.500000 0.500000 -0.000000 Pr\n",
"nsites": 4,
"nelements": 2,
"elements": [
"La",
"Pr"
],
"chemical_system": "La-Pr",
"density": 6.541050738930235,
"density_atomic": 0.028054939443237305,
"volume": 142.5773884877947,
"volume_molar": 21.465527566667582,
"formula_full": "La1 Pr3",
"formula_reduced": "LaPr3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.7308986375,
"spacegroup": 221
},
{
"id": "jvasp-99536",
"created_at": "2022-09-04T14:36:31.827073Z",
"updated_at": "2022-09-04T14:36:31.827099Z",
"structure_string": "La1 Pr1 Tl2\n1.0\n4.827363 -0.000000 2.787080\n1.609121 4.551282 2.787080\n-0.000000 -0.000000 5.574159\nLa Pr Tl\n1 1 2\ndirect\n0.500000 0.500000 0.500000 La\n0.000000 0.000000 0.000000 Pr\n0.749999 0.750000 0.750001 Tl\n0.250000 0.250000 0.250000 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Pr",
"Tl"
],
"chemical_system": "La-Pr-Tl",
"density": 9.336417624374075,
"density_atomic": 0.03266156089961855,
"volume": 122.46812123564844,
"volume_molar": 18.4380066173455,
"formula_full": "La1 Pr1 Tl2",
"formula_reduced": "LaPrTl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4652800125,
"spacegroup": 225
},
{
"id": "jvasp-22202",
"created_at": "2022-09-04T14:37:35.060430Z",
"updated_at": "2022-09-04T14:37:35.060452Z",
"structure_string": "La1 P12 Ru4\n1.0\n6.654885 0.000000 -2.352858\n-3.327442 5.763300 -2.352858\n-0.000000 -0.000000 7.058572\nLa P Ru\n1 12 4\ndirect\n0.000000 0.000000 0.000000 La\n0.642528 0.498420 0.855892 P\n0.855893 0.357472 0.213364 P\n0.642528 0.786636 0.144107 P\n0.357473 0.213364 0.855892 P\n0.144108 0.642528 0.786636 P\n0.498421 0.855893 0.642527 P\n0.357473 0.501580 0.144107 P\n0.144108 0.357472 0.501580 P\n0.786637 0.144107 0.642527 P\n0.213364 0.855893 0.357472 P\n0.501580 0.144107 0.357472 P\n0.855893 0.642528 0.498420 P\n0.500001 0.500000 0.500000 Ru\n0.500000 -0.000000 -0.000000 Ru\n0.000000 0.000000 0.500000 Ru\n0.000000 0.500000 -0.000000 Ru\n",
"nsites": 17,
"nelements": 3,
"elements": [
"La",
"P",
"Ru"
],
"chemical_system": "La-P-Ru",
"density": 5.611515214877219,
"density_atomic": 0.06279430970042707,
"volume": 270.72516731375714,
"volume_molar": 9.590265087282333,
"formula_full": "La1 P12 Ru4",
"formula_reduced": "La(P3Ru)4",
"formula_anonymous": "AB4C12",
"energy_above_hull": 4.057224294117647,
"spacegroup": 204
},
{
"id": "jvasp-107664",
"created_at": "2022-09-04T14:36:58.616558Z",
"updated_at": "2022-09-04T14:36:58.616593Z",
"structure_string": "La1 Pr1 Zn2\n1.0\n4.563557 -0.000000 2.634771\n1.521186 4.302563 2.634771\n-0.000000 -0.000000 5.269541\nLa Pr Zn\n1 1 2\ndirect\n0.500001 0.500000 0.499999 La\n0.000000 0.000000 0.000000 Pr\n0.750001 0.750000 0.749999 Zn\n0.250000 0.250000 0.250000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Pr",
"Zn"
],
"chemical_system": "La-Pr-Zn",
"density": 6.590182653271582,
"density_atomic": 0.03865952252798251,
"volume": 103.46739272593766,
"volume_molar": 15.577380076644918,
"formula_full": "La1 Pr1 Zn2",
"formula_reduced": "LaPrZn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0081214125,
"spacegroup": 225
},
{
"id": "jvasp-19890",
"created_at": "2022-09-04T14:36:20.228412Z",
"updated_at": "2022-09-04T14:36:20.228434Z",
"structure_string": "La2 Pt4\n1.0\n4.815992 0.000000 2.780514\n1.605330 4.540560 2.780514\n-0.000000 -0.000000 5.561028\nLa Pt\n2 4\ndirect\n0.875000 0.875000 0.874999 La\n0.125000 0.125000 0.125000 La\n0.500000 0.500000 0.500000 Pt\n0.500000 0.500000 -0.000001 Pt\n-0.000000 0.500000 0.500000 Pt\n0.500000 -0.000000 0.500000 Pt\n",
"nsites": 6,
"nelements": 2,
"elements": [
"La",
"Pt"
],
"chemical_system": "La-Pt",
"density": 14.449233865040995,
"density_atomic": 0.04934020991801367,
"volume": 121.60467111854452,
"volume_molar": 12.205340775823029,
"formula_full": "La2 Pt4",
"formula_reduced": "LaPt2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.7360159333333334,
"spacegroup": 227
}
]
}