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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_full&page=3887",
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"results": [
{
"id": "jvasp-54935",
"created_at": "2022-09-04T14:38:29.722595Z",
"updated_at": "2022-09-04T14:38:29.722617Z",
"structure_string": "Tb4 Ga12 Pd1\n1.0\n7.056411 -0.000000 -2.494818\n-3.528205 6.111031 -2.494818\n0.000000 0.000000 7.484454\nTb Ga Pd\n4 12 1\ndirect\n0.500000 0.000000 -0.000000 Tb\n0.500000 0.500000 0.500000 Tb\n-0.000000 -0.000000 0.500000 Tb\n0.000000 0.500000 -0.000000 Tb\n0.703285 0.703285 -0.000000 Ga\n0.750000 0.500000 0.250000 Ga\n0.500000 0.250000 0.749999 Ga\n0.296715 0.296715 -0.000000 Ga\n0.750000 0.250000 0.500000 Ga\n0.500000 0.750000 0.250000 Ga\n0.296715 0.000000 0.296715 Ga\n0.000000 0.703285 0.703284 Ga\n0.703285 0.000000 0.703284 Ga\n0.250000 0.500000 0.750000 Ga\n0.000000 0.296715 0.296715 Ga\n0.250000 0.750000 0.500000 Ga\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 17,
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"elements": [
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],
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"density": 8.12301062586576,
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"volume": 322.7442239947935,
"volume_molar": 11.433006743374213,
"formula_full": "Tb4 Ga12 Pd1",
"formula_reduced": "Tb4Ga12Pd",
"formula_anonymous": "AB4C12",
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"spacegroup": 229
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{
"id": "jvasp-86080",
"created_at": "2022-09-04T14:36:02.412312Z",
"updated_at": "2022-09-04T14:36:02.412337Z",
"structure_string": "Tb4 Ga12 Pt1\n1.0\n7.052107 0.000000 -2.493296\n-3.526054 6.107304 -2.493296\n-0.000000 -0.000000 7.479889\nTb Ga Pt\n4 12 1\ndirect\n0.500000 -0.000000 -0.000000 Tb\n0.500000 0.500000 0.500000 Tb\n0.000000 0.000000 0.500000 Tb\n0.000000 0.500000 -0.000000 Tb\n0.702583 0.702582 -0.000001 Ga\n0.750000 0.500000 0.249999 Ga\n0.500000 0.250000 0.750000 Ga\n0.000000 0.702582 0.702582 Ga\n0.297417 0.297417 -0.000000 Ga\n0.250000 0.500000 0.750000 Ga\n0.297417 0.000000 0.297417 Ga\n0.500000 0.749999 0.249999 Ga\n0.250000 0.749999 0.499999 Ga\n0.702583 0.000000 0.702583 Ga\n0.000000 0.297417 0.297417 Ga\n0.750000 0.250000 0.500000 Ga\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 17,
"nelements": 3,
"elements": [
"Tb",
"Ga",
"Pt"
],
"chemical_system": "Ga-Pt-Tb",
"density": 8.59490938476497,
"density_atomic": 0.052769786490444344,
"volume": 322.15404174656635,
"volume_molar": 11.412099916474935,
"formula_full": "Tb4 Ga12 Pt1",
"formula_reduced": "Tb4Ga12Pt",
"formula_anonymous": "AB4C12",
"energy_above_hull": 0.189288994117647,
"spacegroup": 229
},
{
"id": "jvasp-86680",
"created_at": "2022-09-04T14:38:11.679824Z",
"updated_at": "2022-09-04T14:38:11.679838Z",
"structure_string": "Tb4 Ga12 Pt1\n1.0\n7.052091 0.000000 -2.493290\n-3.526045 6.107290 -2.493290\n-0.000000 -0.000000 7.479872\nTb Ga Pt\n4 12 1\ndirect\n0.500000 -0.000000 -0.000000 Tb\n0.500000 0.500000 0.500000 Tb\n0.000000 0.000000 0.500000 Tb\n-0.000000 0.500000 -0.000000 Tb\n0.702582 0.702582 -0.000000 Ga\n0.750000 0.500000 0.250000 Ga\n0.500000 0.250000 0.750000 Ga\n-0.000000 0.702582 0.702582 Ga\n0.297417 0.297418 -0.000000 Ga\n0.250000 0.500000 0.750000 Ga\n0.297418 0.000000 0.297418 Ga\n0.499999 0.750000 0.250000 Ga\n0.250000 0.750000 0.500000 Ga\n0.702582 0.000000 0.702582 Ga\n-0.000000 0.297418 0.297418 Ga\n0.750000 0.250000 0.500000 Ga\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 17,
"nelements": 3,
"elements": [
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"Ga",
"Pt"
],
"chemical_system": "Ga-Pt-Tb",
"density": 8.59496812198707,
"density_atomic": 0.05277014711677914,
"volume": 322.15184017545727,
"volume_molar": 11.412021927233098,
"formula_full": "Tb4 Ga12 Pt1",
"formula_reduced": "Tb4Ga12Pt",
"formula_anonymous": "AB4C12",
"energy_above_hull": 0.189288994117647,
"spacegroup": 229
},
{
"id": "jvasp-50429",
"created_at": "2022-09-04T14:36:51.567389Z",
"updated_at": "2022-09-04T14:36:51.567417Z",
"structure_string": "Tb4 Ga4 O12\n1.0\n5.305843 0.000000 0.000000\n0.000000 5.600588 0.000000\n0.000000 0.000000 7.620040\nTb Ga O\n4 4 12\ndirect\n0.018485 0.067896 0.990926 Tb\n0.481515 0.567896 0.990926 Tb\n0.518484 0.432105 0.490926 Tb\n0.981515 0.932105 0.490926 Tb\n-0.000002 0.500000 0.240925 Ga\n0.500001 -0.000000 0.240925 Ga\n0.499998 0.000000 0.740925 Ga\n0.000002 0.500000 0.740925 Ga\n0.805232 0.196669 0.295501 O\n0.694768 0.696669 0.295501 O\n0.694766 0.696670 0.686351 O\n0.606680 0.965389 0.990927 O\n0.393319 0.034611 0.490927 O\n0.194767 0.803331 0.186351 O\n0.305232 0.303331 0.795501 O\n0.194768 0.803331 0.795501 O\n0.805233 0.196669 0.686351 O\n0.106680 0.534612 0.490927 O\n0.305233 0.303331 0.186351 O\n0.893319 0.465389 0.990927 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Tb",
"Ga",
"O"
],
"chemical_system": "Ga-O-Tb",
"density": 8.115010305778732,
"density_atomic": 0.08832521921408111,
"volume": 226.43589427753756,
"volume_molar": 6.818144142279048,
"formula_full": "Tb4 Ga4 O12",
"formula_reduced": "TbGaO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.162772245,
"spacegroup": 62
},
{
"id": "jvasp-21817",
"created_at": "2022-09-04T14:37:29.112665Z",
"updated_at": "2022-09-04T14:37:29.112692Z",
"structure_string": "Tb4 Ga4 Pd4\n1.0\n4.464409 -0.000000 0.000000\n-0.000000 6.933454 0.000000\n0.000000 0.000000 7.662340\nTb Ga Pd\n4 4 4\ndirect\n0.250000 0.483925 0.200636 Tb\n0.750000 0.516074 0.799364 Tb\n0.250000 0.983925 0.299364 Tb\n0.750000 0.016074 0.700636 Tb\n0.250000 0.820834 0.922251 Ga\n0.750000 0.179165 0.077749 Ga\n0.250000 0.320834 0.577749 Ga\n0.750000 0.679165 0.422251 Ga\n0.750000 0.780760 0.094168 Pd\n0.250000 0.219239 0.905832 Pd\n0.750000 0.280760 0.405832 Pd\n0.250000 0.719239 0.594168 Pd\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Tb",
"Ga",
"Pd"
],
"chemical_system": "Ga-Pd-Tb",
"density": 9.383556284209671,
"density_atomic": 0.05059483844930881,
"volume": 237.1783440325213,
"volume_molar": 11.902678108229576,
"formula_full": "Tb4 Ga4 Pd4",
"formula_reduced": "TbGaPd",
"formula_anonymous": "ABC",
"energy_above_hull": 0.4856321416666666,
"spacegroup": 62
},
{
"id": "jvasp-111676",
"created_at": "2022-09-04T14:38:41.874584Z",
"updated_at": "2022-09-04T14:38:41.874614Z",
"structure_string": "Tb4 Ga4 Pd8\n1.0\n5.634044 0.000000 0.000000\n0.000000 7.157009 0.000000\n0.000000 0.000000 7.329721\nTb Ga Pd\n4 4 8\ndirect\n0.355091 0.750000 0.029020 Tb\n0.144908 0.750000 0.529020 Tb\n0.644908 0.250000 0.970980 Tb\n0.855091 0.250000 0.470980 Tb\n0.643417 0.750000 0.385190 Ga\n0.856582 0.750000 0.885189 Ga\n0.356583 0.250000 0.614810 Ga\n0.143417 0.250000 0.114810 Ga\n0.913055 0.550939 0.185425 Pd\n0.586944 0.949061 0.685425 Pd\n0.086945 0.050939 0.814575 Pd\n0.413055 0.449061 0.314575 Pd\n0.086945 0.449061 0.814575 Pd\n0.413055 0.050939 0.314575 Pd\n0.913055 0.949061 0.185425 Pd\n0.586944 0.550939 0.685425 Pd\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Tb",
"Ga",
"Pd"
],
"chemical_system": "Ga-Pd-Tb",
"density": 9.921768625172888,
"density_atomic": 0.054135324086890396,
"volume": 295.5556334034143,
"volume_molar": 11.124235167289493,
"formula_full": "Tb4 Ga4 Pd8",
"formula_reduced": "TbGaPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.85494303125,
"spacegroup": 62
},
{
"id": "jvasp-23756",
"created_at": "2022-09-04T14:37:39.073719Z",
"updated_at": "2022-09-04T14:37:39.073743Z",
"structure_string": "Tb4 Ga4 Pt4\n1.0\n4.431551 -0.000000 0.000000\n-0.000000 6.921147 0.000000\n0.000000 0.000000 7.707474\nTb Ga Pt\n4 4 4\ndirect\n0.750000 0.514719 0.801045 Tb\n0.250000 0.985281 0.301045 Tb\n0.250000 0.485281 0.198955 Tb\n0.750000 0.014719 0.698954 Tb\n0.750000 0.673347 0.423560 Ga\n0.250000 0.326653 0.576439 Ga\n0.750000 0.173347 0.076440 Ga\n0.250000 0.826653 0.923560 Ga\n0.250000 0.724359 0.596759 Pt\n0.250000 0.224359 0.903241 Pt\n0.750000 0.775642 0.096759 Pt\n0.750000 0.275641 0.403241 Pt\n",
"nsites": 12,
"nelements": 3,
"elements": [
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"Ga",
"Pt"
],
"chemical_system": "Ga-Pt-Tb",
"density": 11.90569676332129,
"density_atomic": 0.05076160584343473,
"volume": 236.39914066178076,
"volume_molar": 11.863574171735696,
"formula_full": "Tb4 Ga4 Pt4",
"formula_reduced": "TbGaPt",
"formula_anonymous": "ABC",
"energy_above_hull": 0.6942207083333333,
"spacegroup": 62
},
{
"id": "jvasp-122042",
"created_at": "2022-09-04T14:38:52.042617Z",
"updated_at": "2022-09-04T14:38:52.042641Z",
"structure_string": "Tb4 Ge10 Rh6\n1.0\n7.853013 0.081000 2.917157\n-1.306040 7.744071 2.917157\n0.062515 0.074719 5.998515\nTb Ge Rh\n4 10 6\ndirect\n0.864279 0.593723 0.770977 Tb\n0.406277 0.135721 0.729024 Tb\n0.135720 0.406278 0.229024 Tb\n0.593722 0.864279 0.270977 Tb\n0.220237 0.779762 0.250000 Ge\n0.779762 0.220238 0.750000 Ge\n0.499993 0.500007 0.250000 Ge\n0.500006 0.499993 0.750000 Ge\n0.779772 0.220228 0.250001 Ge\n0.260239 0.067592 0.336113 Ge\n0.932407 0.739761 0.163888 Ge\n0.739760 0.932408 0.663888 Ge\n0.067592 0.260239 0.836112 Ge\n0.220227 0.779772 0.750000 Ge\n-0.000012 0.000011 0.750000 Rh\n0.250833 0.535767 0.606710 Rh\n0.464232 0.749166 0.893291 Rh\n0.749166 0.464233 0.393291 Rh\n0.535767 0.250834 0.106710 Rh\n0.000011 -0.000011 0.250000 Rh\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Tb",
"Ge",
"Rh"
],
"chemical_system": "Ge-Rh-Tb",
"density": 9.079463924075359,
"density_atomic": 0.055243101403056445,
"volume": 362.03615459745816,
"volume_molar": 10.901163415975072,
"formula_full": "Tb4 Ge10 Rh6",
"formula_reduced": "Tb2Ge5Rh3",
"formula_anonymous": "A2B3C5",
"energy_above_hull": 1.7843755550000002,
"spacegroup": 72
},
{
"id": "jvasp-23844",
"created_at": "2022-09-04T14:37:38.955941Z",
"updated_at": "2022-09-04T14:37:38.955966Z",
"structure_string": "Tb4 Ge4 Ir4\n1.0\n4.339784 0.000000 0.000000\n0.000000 6.908909 0.000000\n0.000000 0.000000 7.614996\nTb Ge Ir\n4 4 4\ndirect\n0.749999 0.498433 0.806790 Tb\n0.250000 0.001567 0.306790 Tb\n0.749999 0.998433 0.693211 Tb\n0.250000 0.501567 0.193210 Tb\n0.250000 0.794159 0.894447 Ge\n0.250000 0.294159 0.605554 Ge\n0.749999 0.205841 0.105553 Ge\n0.749999 0.705841 0.394447 Ge\n0.250000 0.666404 0.570597 Ir\n0.250000 0.166404 0.929404 Ir\n0.749999 0.833596 0.070596 Ir\n0.749999 0.333596 0.429404 Ir\n",
"nsites": 12,
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"elements": [
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"Ge",
"Ir"
],
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"density": 12.328342391323446,
"density_atomic": 0.05255741295762902,
"volume": 228.3217404493295,
"volume_molar": 11.458213829617065,
"formula_full": "Tb4 Ge4 Ir4",
"formula_reduced": "TbGeIr",
"formula_anonymous": "ABC",
"energy_above_hull": 1.7141118166666665,
"spacegroup": 62
},
{
"id": "jvasp-23774",
"created_at": "2022-09-04T14:37:38.331212Z",
"updated_at": "2022-09-04T14:37:38.331232Z",
"structure_string": "Tb4 Ge4 Pt4\n1.0\n4.386571 0.000000 0.000000\n-0.000000 7.055971 0.000000\n0.000000 0.000000 7.645022\nTb Ge Pt\n4 4 4\ndirect\n0.750000 0.503035 0.796210 Tb\n0.250000 0.996965 0.296210 Tb\n0.750000 0.003035 0.703790 Tb\n0.250000 0.496965 0.203790 Tb\n0.250000 0.810470 0.911273 Ge\n0.250000 0.310470 0.588726 Ge\n0.750000 0.189530 0.088726 Ge\n0.750000 0.689530 0.411273 Ge\n0.250000 0.707124 0.584024 Pt\n0.250000 0.207124 0.915975 Pt\n0.750000 0.792876 0.084024 Pt\n0.750000 0.292876 0.415976 Pt\n",
"nsites": 12,
"nelements": 3,
"elements": [
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],
"chemical_system": "Ge-Pt-Tb",
"density": 11.976212333736804,
"density_atomic": 0.05071314638379393,
"volume": 236.6250342501873,
"volume_molar": 11.874910529953741,
"formula_full": "Tb4 Ge4 Pt4",
"formula_reduced": "TbGePt",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0570052500000002,
"spacegroup": 62
},
{
"id": "jvasp-23329",
"created_at": "2022-09-04T14:37:38.546618Z",
"updated_at": "2022-09-04T14:37:38.546642Z",
"structure_string": "Tb4 Ge4 Ru2\n1.0\n4.165169 -0.000000 0.991660\n2.008419 5.393728 0.807342\n-0.009932 -0.011762 9.284815\nTb Ge Ru\n4 4 2\ndirect\n0.316200 0.756061 0.611539 Tb\n0.683801 0.243940 0.388460 Tb\n0.501503 0.170255 0.826740 Tb\n0.498498 0.829746 0.173260 Tb\n0.146247 0.773539 0.933969 Ge\n0.853754 0.226462 0.066030 Ge\n0.013895 0.348063 0.624146 Ge\n0.986106 0.651937 0.375853 Ge\n0.226952 0.416917 0.129177 Ru\n0.773048 0.583084 0.870822 Ru\n",
"nsites": 10,
"nelements": 3,
"elements": [
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"Ge",
"Ru"
],
"chemical_system": "Ge-Ru-Tb",
"density": 8.979944084334546,
"density_atomic": 0.04792486726042728,
"volume": 208.65994152178365,
"volume_molar": 12.5657953881755,
"formula_full": "Tb4 Ge4 Ru2",
"formula_reduced": "Tb2Ge2Ru",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.7511518400000003,
"spacegroup": 12
},
{
"id": "jvasp-98093",
"created_at": "2022-09-04T14:35:54.570040Z",
"updated_at": "2022-09-04T14:35:54.570062Z",
"structure_string": "Tb4 Ge6 Pt18\n1.0\n7.248510 0.012421 -2.999538\n-4.237618 6.601376 -0.052221\n-0.021544 -0.026212 10.099839\nTb Ge Pt\n4 6 18\ndirect\n0.497036 0.584711 0.251002 Tb\n0.502964 0.415290 0.748999 Tb\n0.166291 0.753966 0.751002 Tb\n0.833709 0.246035 0.248998 Tb\n0.000000 0.000000 0.500000 Ge\n0.320347 0.637247 0.502900 Ge\n0.365653 0.182553 0.002899 Ge\n0.634348 0.817447 0.997101 Ge\n0.679654 0.362754 0.497101 Ge\n0.000000 0.500000 0.000000 Ge\n0.825664 0.295021 0.740316 Pt\n0.615372 0.865372 0.750000 Pt\n0.943857 0.794296 0.921859 Pt\n0.054705 0.085347 0.759684 Pt\n0.720616 0.695296 0.580325 Pt\n0.943361 0.640491 0.421624 Pt\n0.372437 0.021997 0.578141 Pt\n0.174337 0.704980 0.259684 Pt\n0.945296 0.914654 0.240316 Pt\n0.385029 0.859709 0.080325 Pt\n0.056144 0.205705 0.078141 Pt\n0.279384 0.304705 0.419675 Pt\n0.056640 0.359510 0.578376 Pt\n0.614971 0.140291 0.919675 Pt\n0.281134 0.478264 0.921624 Pt\n0.384629 0.134629 0.250000 Pt\n0.718866 0.521737 0.078376 Pt\n0.627564 0.978003 0.421859 Pt\n",
"nsites": 28,
"nelements": 3,
"elements": [
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],
"chemical_system": "Ge-Pt-Tb",
"density": 15.755070282994618,
"density_atomic": 0.0579661373114024,
"volume": 483.0406388747276,
"volume_molar": 10.389066857514063,
"formula_full": "Tb4 Ge6 Pt18",
"formula_reduced": "Tb2(GePt3)3",
"formula_anonymous": "A2B3C9",
"energy_above_hull": 2.493752660714286,
"spacegroup": 15
}
]
}