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=energy_above_hull&page=47",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=energy_above_hull&page=45",
"results": [
{
"id": "jvasp-15782",
"created_at": "2022-09-04T14:35:48.976649Z",
"updated_at": "2022-09-04T14:35:48.976676Z",
"structure_string": "Ce1 Zn3 Cu2\n1.0\n2.610801 -4.522040 0.000000\n2.610801 4.522040 -0.000000\n-0.000000 -0.000000 4.233374\nCe Zn Cu\n1 3 2\ndirect\n0.000000 0.000000 0.000000 Ce\n-0.000000 0.500000 0.500000 Zn\n0.500000 -0.000000 0.500000 Zn\n0.500000 0.500000 0.500000 Zn\n0.666667 0.333333 0.000000 Cu\n0.333333 0.666667 0.000000 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Zn",
"Cu"
],
"chemical_system": "Ce-Cu-Zn",
"density": 7.698624253670276,
"density_atomic": 0.06002420912961791,
"volume": 99.95966772412505,
"volume_molar": 10.032853155958499,
"formula_full": "Ce1 Zn3 Cu2",
"formula_reduced": "CeZn3Cu2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 0.0,
"spacegroup": 191
},
{
"id": "jvasp-65263",
"created_at": "2022-09-04T14:35:45.089717Z",
"updated_at": "2022-09-04T14:35:45.089741Z",
"structure_string": "Sr1 Be1 Cu4\n1.0\n-0.000000 3.609037 3.609037\n3.609037 -0.000000 3.609037\n3.609037 3.609037 0.000000\nSr Be Cu\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 Be\n0.118334 0.627223 0.627223 Cu\n0.627223 0.627223 0.627223 Cu\n0.627223 0.118334 0.627223 Cu\n0.627223 0.627223 0.118334 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sr",
"Be",
"Cu"
],
"chemical_system": "Be-Cu-Sr",
"density": 6.196189851255876,
"density_atomic": 0.06381859683914133,
"volume": 94.01648261122642,
"volume_molar": 9.436341534081633,
"formula_full": "Sr1 Be1 Cu4",
"formula_reduced": "SrBeCu4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-67817",
"created_at": "2022-09-04T14:35:50.398632Z",
"updated_at": "2022-09-04T14:35:50.398647Z",
"structure_string": "Be1 Ga1 Cu4\n1.0\n-0.000000 3.386880 3.386880\n3.386880 0.000000 3.386880\n3.386880 3.386880 -0.000000\nBe Ga Cu\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Ga\n0.123883 0.625372 0.625372 Cu\n0.625372 0.625372 0.625372 Cu\n0.625372 0.123883 0.625372 Cu\n0.625372 0.625372 0.123883 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Be",
"Ga",
"Cu"
],
"chemical_system": "Be-Cu-Ga",
"density": 7.1147311251134235,
"density_atomic": 0.07721858271259271,
"volume": 77.70150382495336,
"volume_molar": 7.798823221625792,
"formula_full": "Be1 Ga1 Cu4",
"formula_reduced": "BeGaCu4",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-70924",
"created_at": "2022-09-04T14:35:55.099104Z",
"updated_at": "2022-09-04T14:35:55.099130Z",
"structure_string": "Mg2 Be1 Cl1\n1.0\n3.291303 0.000000 -0.000000\n-0.000000 3.291303 -0.000000\n-0.000000 -0.000000 7.678686\nMg Be Cl\n2 1 1\ndirect\n-0.000000 -0.000000 -0.022705 Mg\n0.500000 0.500000 0.438334 Mg\n0.000000 0.000000 0.291702 Be\n0.500000 0.500000 0.792670 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mg",
"Be",
"Cl"
],
"chemical_system": "Be-Cl-Mg",
"density": 1.8580626427235314,
"density_atomic": 0.048088070477243026,
"volume": 83.18071322684784,
"volume_molar": 12.52314908923179,
"formula_full": "Mg2 Be1 Cl1",
"formula_reduced": "Mg2BeCl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-91835",
"created_at": "2022-09-04T14:35:50.206690Z",
"updated_at": "2022-09-04T14:35:50.206717Z",
"structure_string": "Er2 Cd4 Cu2\n1.0\n4.594454 0.000000 0.000000\n-0.000000 5.789575 -2.439581\n0.000000 -0.017814 6.282550\nEr Cd Cu\n2 4 2\ndirect\n0.250000 0.859324 0.140677 Er\n0.749999 0.140677 0.859324 Er\n0.749999 0.194934 0.386231 Cd\n0.250000 0.805067 0.613770 Cd\n0.749999 0.613770 0.805067 Cd\n0.250000 0.386231 0.194934 Cd\n0.749999 0.679994 0.320007 Cu\n0.250000 0.320008 0.679994 Cu\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Er",
"Cd",
"Cu"
],
"chemical_system": "Cd-Cu-Er",
"density": 9.065488335296493,
"density_atomic": 0.047928368452405105,
"volume": 166.9157590445487,
"volume_molar": 12.564877450356443,
"formula_full": "Er2 Cd4 Cu2",
"formula_reduced": "ErCd2Cu",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 63
},
{
"id": "jvasp-90854",
"created_at": "2022-09-04T14:35:43.386296Z",
"updated_at": "2022-09-04T14:35:43.386320Z",
"structure_string": "K1 Cd4 As3\n1.0\n-2.266297 -3.925342 0.000000\n2.266297 -3.925342 0.000000\n-0.000000 -2.616894 12.031292\nK Cd As\n1 4 3\ndirect\n0.500000 0.500000 0.500000 K\n0.089762 0.089762 0.730713 Cd\n0.910237 0.910237 0.269287 Cd\n0.301042 0.301042 0.096873 Cd\n0.698957 0.698957 0.903127 Cd\n0.226460 0.226460 0.320621 As\n0.773540 0.773540 0.679379 As\n0.000000 0.000000 0.000000 As\n",
"nsites": 8,
"nelements": 3,
"elements": [
"K",
"Cd",
"As"
],
"chemical_system": "As-Cd-K",
"density": 5.534913123847254,
"density_atomic": 0.03737260743468236,
"volume": 214.06052585391396,
"volume_molar": 16.113782723148613,
"formula_full": "K1 Cd4 As3",
"formula_reduced": "KCd4As3",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.0,
"spacegroup": 166
},
{
"id": "jvasp-3183",
"created_at": "2022-09-04T14:35:44.675609Z",
"updated_at": "2022-09-04T14:35:44.675636Z",
"structure_string": "Sr2 Cu2 S2 F2\n1.0\n3.961285 0.000000 0.000000\n0.000000 3.961285 0.000000\n0.000000 0.000000 8.660582\nSr Cu S F\n2 2 2 2\ndirect\n0.000000 0.499999 0.830133 Sr\n0.499999 0.000000 0.169867 Sr\n0.499999 0.499999 0.500000 Cu\n0.000000 0.000000 0.500000 Cu\n0.499999 0.000000 0.664121 S\n0.000000 0.499999 0.335879 S\n0.499999 0.499999 0.000000 F\n0.000000 0.000000 0.000000 F\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Sr",
"Cu",
"S",
"F"
],
"chemical_system": "Cu-F-S-Sr",
"density": 4.942015878566441,
"density_atomic": 0.058866840920721517,
"volume": 135.89993746689993,
"volume_molar": 10.230106908760865,
"formula_full": "Sr2 Cu2 S2 F2",
"formula_reduced": "SrCuSF",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.0,
"spacegroup": 129
},
{
"id": "jvasp-18841",
"created_at": "2022-09-04T14:35:45.681969Z",
"updated_at": "2022-09-04T14:35:45.681981Z",
"structure_string": "Sr3 In1\n1.0\n5.222009 -0.000000 3.014928\n1.740670 4.923358 3.014928\n0.000000 -0.000000 6.029857\nSr In\n3 1\ndirect\n0.750000 0.750000 0.750001 Sr\n0.500000 0.500000 0.500000 Sr\n0.250000 0.250000 0.250000 Sr\n0.000000 0.000000 0.000000 In\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Sr",
"In"
],
"chemical_system": "In-Sr",
"density": 4.0454304567054855,
"density_atomic": 0.025802034170367947,
"volume": 155.02653680668925,
"volume_molar": 23.339790654630093,
"formula_full": "Sr3 In1",
"formula_reduced": "Sr3In",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-69129",
"created_at": "2022-09-04T14:36:00.035498Z",
"updated_at": "2022-09-04T14:36:00.035520Z",
"structure_string": "Ba2 Tl1 Hg1\n1.0\n0.000000 4.207891 4.207891\n4.207891 -0.000000 4.207891\n4.207891 4.207891 -0.000000\nBa Tl Hg\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Hg"
],
"chemical_system": "Ba-Hg-Tl",
"density": 7.573497269967856,
"density_atomic": 0.02684333994292668,
"volume": 149.0127535733129,
"volume_molar": 22.434394426342084,
"formula_full": "Ba2 Tl1 Hg1",
"formula_reduced": "Ba2TlHg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-92936",
"created_at": "2022-09-04T14:35:45.323234Z",
"updated_at": "2022-09-04T14:35:45.323252Z",
"structure_string": "Rb1 Mg6 Ga1\n1.0\n6.814391 0.739512 0.000000\n-2.766759 6.271191 0.000000\n0.000000 0.000000 4.880536\nRb Mg Ga\n1 6 1\ndirect\n0.122234 0.377766 0.250000 Rb\n0.200379 0.903740 0.250000 Mg\n0.596259 0.299621 0.250000 Mg\n0.691262 0.808737 0.250000 Mg\n0.399978 0.724853 0.750001 Mg\n0.775147 0.100021 0.750001 Mg\n0.861905 0.638095 0.750001 Mg\n0.352833 0.147166 0.750001 Ga\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Rb",
"Mg",
"Ga"
],
"chemical_system": "Ga-Mg-Rb",
"density": 2.287126172274002,
"density_atomic": 0.03660450241331852,
"volume": 218.5523493713496,
"volume_molar": 16.45191264178706,
"formula_full": "Rb1 Mg6 Ga1",
"formula_reduced": "RbMg6Ga",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-91402",
"created_at": "2022-09-04T14:35:53.439344Z",
"updated_at": "2022-09-04T14:35:53.439367Z",
"structure_string": "Ba4 Mg6 F20\n1.0\n5.697595 0.000000 -1.832872\n-0.902879 7.260793 -2.806652\n0.004954 0.010640 9.787492\nBa Mg F\n4 6 20\ndirect\n0.717436 0.315029 0.434875 Ba\n0.282562 0.684971 0.565124 Ba\n0.614027 0.719592 0.228056 Ba\n0.385972 0.280408 0.771944 Ba\n0.253734 -0.000000 0.000000 Mg\n0.177197 0.016179 0.354395 Mg\n0.746265 -0.000000 0.000000 Mg\n0.073825 0.453853 0.147651 Mg\n0.926173 0.546147 0.852348 Mg\n0.822801 0.983821 0.645605 Mg\n0.866345 0.256602 0.732691 F\n0.780513 0.500000 0.000000 F\n0.219486 0.500000 0.000000 F\n0.517107 0.180965 0.034215 F\n0.482891 0.819035 0.965785 F\n0.236520 0.281027 0.473041 F\n0.763478 0.718973 0.526959 F\n0.133653 0.743397 0.267309 F\n0.021788 0.181971 0.043576 F\n0.089840 0.526911 0.704154 F\n0.614313 0.526911 0.704154 F\n0.910158 0.473089 0.295845 F\n0.385686 0.473089 0.295845 F\n-0.000000 -0.000000 0.500000 F\n0.636347 0.973910 0.778625 F\n0.857722 0.026090 0.221374 F\n0.363651 0.026090 0.221374 F\n0.142276 0.973910 0.778625 F\n0.978210 0.818028 0.956424 F\n0.499999 -0.000000 0.500000 F\n",
"nsites": 30,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"F"
],
"chemical_system": "Ba-F-Mg",
"density": 4.406373880564509,
"density_atomic": 0.07404610014119624,
"volume": 405.15300526015443,
"volume_molar": 8.1329614233789,
"formula_full": "Ba4 Mg6 F20",
"formula_reduced": "Ba2Mg3F10",
"formula_anonymous": "A2B3C10",
"energy_above_hull": 0.0,
"spacegroup": 12
},
{
"id": "jvasp-66484",
"created_at": "2022-09-04T14:36:22.672698Z",
"updated_at": "2022-09-04T14:36:22.672731Z",
"structure_string": "Ba2 In1 Ni1\n1.0\n0.000000 4.050526 4.050526\n4.050526 -0.000000 4.050526\n4.050526 4.050526 -0.000000\nBa In Ni\n2 1 1\ndirect\n0.750001 0.750001 0.750001 Ba\n0.250000 0.250000 0.250000 Ba\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.500000 Ni\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"In",
"Ni"
],
"chemical_system": "Ba-In-Ni",
"density": 5.599163552891878,
"density_atomic": 0.030095095306714125,
"volume": 132.91202301351782,
"volume_molar": 20.010372782094095,
"formula_full": "Ba2 In1 Ni1",
"formula_reduced": "Ba2InNi",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
}
]
}