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=286",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-energy_above_hull&page=284",
"results": [
{
"id": "jvasp-35389",
"created_at": "2022-09-04T14:37:50.814280Z",
"updated_at": "2022-09-04T14:37:50.814299Z",
"structure_string": "Ho2 B4 C1\n1.0\n-3.262622 -0.000000 -0.000000\n-1.631310 -3.275909 3.753255\n-1.631310 3.275909 3.753255\nHo B C\n2 4 1\ndirect\n0.265617 0.234383 0.234383 Ho\n0.734381 0.765618 0.765618 Ho\n0.499999 0.365700 0.634301 B\n0.499999 0.634301 0.365700 B\n-0.000001 0.772669 0.227332 B\n-0.000001 0.227332 0.772669 B\n0.000000 0.000000 0.000000 C\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Ho",
"B",
"C"
],
"chemical_system": "B-C-Ho",
"density": 7.97082470766474,
"density_atomic": 0.08724918582989145,
"volume": 80.22997502403982,
"volume_molar": 6.902231468086459,
"formula_full": "Ho2 B4 C1",
"formula_reduced": "Ho2B4C",
"formula_anonymous": "AB2C4",
"energy_above_hull": 4.266197352380953,
"spacegroup": 71
},
{
"id": "jvasp-37463",
"created_at": "2022-09-04T14:38:08.553148Z",
"updated_at": "2022-09-04T14:38:08.553173Z",
"structure_string": "Y1 Nb1 Ru2\n1.0\n-0.000000 3.276329 3.276329\n3.276329 -0.000000 3.276329\n3.276329 3.276329 -0.000000\nY Nb Ru\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Y\n0.250000 0.250000 0.250000 Nb\n0.000000 0.000000 0.000000 Ru\n0.500000 0.500000 0.500000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Y",
"Nb",
"Ru"
],
"chemical_system": "Nb-Ru-Y",
"density": 9.064289719016202,
"density_atomic": 0.056867937551710865,
"volume": 70.33840459508032,
"volume_molar": 10.589694332635112,
"formula_full": "Y1 Nb1 Ru2",
"formula_reduced": "YNbRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.2653064625,
"spacegroup": 225
},
{
"id": "jvasp-74462",
"created_at": "2022-09-04T14:36:17.510487Z",
"updated_at": "2022-09-04T14:36:17.510513Z",
"structure_string": "Be2 Tc1 W1\n1.0\n-1.774868 1.774868 3.855072\n1.774868 -1.774868 3.855072\n1.774868 1.774868 -3.855072\nBe Tc W\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.750000 0.500000 Be\n0.500000 0.500000 0.000000 Tc\n0.750000 0.250000 0.500000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Tc",
"W"
],
"chemical_system": "Be-Tc-W",
"density": 10.250601512958337,
"density_atomic": 0.0823446499391796,
"volume": 48.57631920172629,
"volume_molar": 7.3133357958871645,
"formula_full": "Be2 Tc1 W1",
"formula_reduced": "Be2TcW",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.265293425,
"spacegroup": 119
},
{
"id": "jvasp-98616",
"created_at": "2022-09-04T14:35:50.439646Z",
"updated_at": "2022-09-04T14:35:50.439672Z",
"structure_string": "Er1 H9 C5 N2 O8\n1.0\n5.292627 3.512781 -1.872938\n-5.292627 3.512781 1.872938\n-0.020797 -0.000000 6.501828\nEr H C N O\n1 9 5 2 8\ndirect\n0.998675 0.998675 0.000000 Er\n0.202554 0.647198 0.400124 H\n0.647198 0.202554 0.599876 H\n0.497231 0.748832 0.527166 H\n0.748831 0.497231 0.472835 H\n0.807412 0.439519 0.888671 H\n0.439519 0.807412 0.111329 H\n0.086293 0.086293 0.500000 H\n0.449172 0.470938 0.823005 H\n0.470938 0.449173 0.176995 H\n0.472652 0.293752 0.296867 C\n0.293751 0.472652 0.703133 C\n0.930270 0.930271 0.500000 C\n0.459355 0.934253 0.957060 C\n0.934253 0.459356 0.042940 C\n0.331842 0.636933 0.530153 N\n0.636933 0.331843 0.469847 N\n0.017638 0.310337 0.130045 O\n0.310337 0.017638 0.869955 O\n0.985214 0.635273 0.121578 O\n0.635273 0.985214 0.878422 O\n0.839615 0.849721 0.669582 O\n0.849721 0.839615 0.330418 O\n0.098894 0.327024 0.734717 O\n0.327024 0.098894 0.265283 O\n",
"nsites": 25,
"nelements": 5,
"elements": [
"Er",
"H",
"C",
"N",
"O"
],
"chemical_system": "C-Er-H-N-O",
"density": 2.698198480822445,
"density_atomic": 0.10352471422716455,
"volume": 241.48823000025322,
"volume_molar": 5.817104451779119,
"formula_full": "Er1 H9 C5 N2 O8",
"formula_reduced": "ErH9C5(NO4)2",
"formula_anonymous": "AB2C5D8E9",
"energy_above_hull": 4.26528738,
"spacegroup": 5
},
{
"id": "jvasp-95209",
"created_at": "2022-09-04T14:35:59.483640Z",
"updated_at": "2022-09-04T14:35:59.483667Z",
"structure_string": "Ca4 H16 N24 O8\n1.0\n10.975644 0.000000 -3.422517\n0.000000 6.060509 0.000000\n-0.080163 0.000000 7.888898\nCa H N O\n4 16 24 8\ndirect\n0.512139 0.745941 0.179834 Ca\n0.012139 0.754059 0.679835 Ca\n0.487861 0.254059 0.820166 Ca\n0.987861 0.245941 0.320165 Ca\n0.109353 0.696213 0.379755 H\n0.609353 0.803787 0.879755 H\n0.890647 0.303787 0.620245 H\n0.390647 0.196213 0.120245 H\n0.696175 0.980273 0.007331 H\n0.803825 0.480273 0.492668 H\n0.303825 0.019728 0.992669 H\n0.196175 0.519728 0.507332 H\n0.702656 0.458629 0.112782 H\n0.797343 0.958629 0.387217 H\n0.297344 0.541371 0.887218 H\n0.129016 0.204193 0.703498 H\n0.629016 0.295807 0.203498 H\n0.870984 0.795808 0.296502 H\n0.370984 0.704193 0.796502 H\n0.202657 0.041371 0.612783 H\n0.629762 0.600404 0.610940 N\n0.129762 0.899596 0.110941 N\n0.608451 0.127790 0.623725 N\n0.108451 0.372210 0.123724 N\n0.391549 0.872210 0.376275 N\n0.659433 0.611615 0.480431 N\n0.340567 0.388385 0.519569 N\n0.840566 0.111615 0.019569 N\n0.159434 0.888385 0.980431 N\n0.870238 0.100404 0.889059 N\n0.891549 0.627791 0.876275 N\n0.370238 0.399596 0.389059 N\n0.900107 0.084948 0.758946 N\n0.373151 0.896946 0.512277 N\n0.645868 0.071922 0.348509 N\n0.873150 0.603054 0.012277 N\n0.354132 0.928078 0.651491 N\n0.854132 0.571922 0.151490 N\n0.400107 0.415052 0.258946 N\n0.145868 0.428078 0.848510 N\n0.599893 0.584948 0.741054 N\n0.099893 0.915052 0.241054 N\n0.626849 0.103054 0.487723 N\n0.126850 0.396946 0.987723 N\n0.382073 0.589378 0.892992 O\n0.882072 0.910622 0.392991 O\n0.617927 0.410622 0.107008 O\n0.117927 0.089378 0.607008 O\n0.388434 0.082552 0.025417 O\n0.888434 0.417448 0.525417 O\n0.611566 0.917449 0.974583 O\n0.111566 0.582552 0.474583 O\n",
"nsites": 52,
"nelements": 4,
"elements": [
"Ca",
"H",
"N",
"O"
],
"chemical_system": "Ca-H-N-O",
"density": 2.033553134207656,
"density_atomic": 0.0994091130507703,
"volume": 523.0908757172244,
"volume_molar": 6.057936315078445,
"formula_full": "Ca4 H16 N24 O8",
"formula_reduced": "CaH4(N3O)2",
"formula_anonymous": "AB2C4D6",
"energy_above_hull": 4.264619763076923,
"spacegroup": 14
},
{
"id": "jvasp-37453",
"created_at": "2022-09-04T14:37:41.067042Z",
"updated_at": "2022-09-04T14:37:41.067070Z",
"structure_string": "Ta1 Ti1 Fe2\n1.0\n0.000000 3.004528 3.004528\n3.004528 -0.000000 3.004528\n3.004528 3.004528 0.000000\nTa Ti Fe\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Ta\n0.750001 0.750001 0.750001 Ti\n0.000000 0.000000 0.000000 Fe\n0.500002 0.500002 0.500002 Fe\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"Ti",
"Fe"
],
"chemical_system": "Fe-Ta-Ti",
"density": 10.42350250801061,
"density_atomic": 0.07373967660862367,
"volume": 54.244881235785215,
"volume_molar": 8.166757757784533,
"formula_full": "Ta1 Ti1 Fe2",
"formula_reduced": "TaTiFe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.264544633333333,
"spacegroup": 225
},
{
"id": "jvasp-119613",
"created_at": "2022-09-04T14:38:52.149924Z",
"updated_at": "2022-09-04T14:38:52.149937Z",
"structure_string": "Tm1 H9 C5 N2 O8\n1.0\n6.358996 0.099236 1.768384\n2.407522 5.886469 1.768384\n0.116592 0.079608 6.485290\nTm H C N O\n1 9 5 2 8\ndirect\n0.545945 0.454056 -0.000001 Tm\n0.749011 0.805266 0.599649 H\n0.194734 0.250989 0.400349 H\n0.044633 0.703382 0.472588 H\n0.296618 0.955367 0.527411 H\n0.997273 -0.017703 0.176385 H\n0.017703 0.002728 0.823614 H\n0.353849 0.012615 0.113089 H\n-0.012616 0.646152 0.886910 H\n0.634951 0.365050 0.499999 H\n0.478587 0.521413 0.499999 C\n0.006877 0.519386 0.041793 C\n0.480614 0.993123 0.958206 C\n0.019428 0.158821 0.703847 C\n0.841179 0.980572 0.296151 C\n0.878848 0.815714 0.469508 N\n0.184287 0.121152 0.530491 N\n0.397947 0.612370 0.669929 O\n0.387631 0.602053 0.330070 O\n0.531627 0.816702 0.879365 O\n0.183299 0.468373 0.120634 O\n0.645976 0.126713 0.264133 O\n0.873288 0.354025 0.735865 O\n0.857092 0.436106 0.129414 O\n0.563894 0.142909 0.870584 O\n",
"nsites": 25,
"nelements": 5,
"elements": [
"Tm",
"H",
"C",
"N",
"O"
],
"chemical_system": "C-H-N-O-Tm",
"density": 2.7326840757524438,
"density_atomic": 0.10440214485492412,
"volume": 239.45868195274798,
"volume_molar": 5.768215555694081,
"formula_full": "Tm1 H9 C5 N2 O8",
"formula_reduced": "TmH9C5(NO4)2",
"formula_anonymous": "AB2C5D8E9",
"energy_above_hull": 4.26438675,
"spacegroup": 5
},
{
"id": "jvasp-71947",
"created_at": "2022-09-04T14:35:41.623038Z",
"updated_at": "2022-09-04T14:35:41.623053Z",
"structure_string": "Ta1 Mn2 Be1\n1.0\n-1.759347 1.759347 4.027496\n1.759347 -1.759347 4.027496\n1.759347 1.759347 -4.027496\nTa Mn Be\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Ta\n0.000000 0.000000 0.000000 Mn\n0.250000 0.750001 0.500001 Mn\n0.750001 0.250000 0.500001 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ta",
"Mn",
"Be"
],
"chemical_system": "Be-Mn-Ta",
"density": 9.984698938680683,
"density_atomic": 0.08021616082604618,
"volume": 49.86526354301913,
"volume_molar": 7.507390902263938,
"formula_full": "Ta1 Mn2 Be1",
"formula_reduced": "TaMn2Be",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.263939945689654,
"spacegroup": 119
},
{
"id": "jvasp-39823",
"created_at": "2022-09-04T14:37:41.509940Z",
"updated_at": "2022-09-04T14:37:41.509960Z",
"structure_string": "Ti3 Os1\n1.0\n-0.000001 3.145887 3.145886\n3.145885 -0.000001 3.145886\n3.145885 3.145887 -0.000001\nTi Os\n3 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500000 0.500001 0.500001 Ti\n0.250001 0.250001 0.250001 Ti\n0.750001 0.750001 0.750001 Os\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ti",
"Os"
],
"chemical_system": "Os-Ti",
"density": 8.90259498534303,
"density_atomic": 0.0642393068942468,
"volume": 62.26717244295541,
"volume_molar": 9.374541929466764,
"formula_full": "Ti3 Os1",
"formula_reduced": "Ti3Os",
"formula_anonymous": "AB3",
"energy_above_hull": 4.263657500000001,
"spacegroup": 225
},
{
"id": "jvasp-115742",
"created_at": "2022-09-04T14:38:46.909882Z",
"updated_at": "2022-09-04T14:38:46.909910Z",
"structure_string": "Co1 C1 O1\n1.0\n5.291772 0.000000 0.000000\n0.000000 5.291772 0.000000\n0.000000 0.000000 9.313520\nCo C O\n1 1 1\ndirect\n0.000000 0.000000 0.824179 Co\n0.000000 0.000000 0.140771 C\n0.000000 0.000000 -0.015990 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Co",
"C",
"O"
],
"chemical_system": "C-Co-O",
"density": 0.5535655987219473,
"density_atomic": 0.011502842018637372,
"volume": 260.805111914019,
"volume_molar": 52.353503162459184,
"formula_full": "Co1 C1 O1",
"formula_reduced": "CoCO",
"formula_anonymous": "ABC",
"energy_above_hull": 4.263524799999999,
"spacegroup": 99
},
{
"id": "jvasp-100362",
"created_at": "2022-09-04T14:36:35.093510Z",
"updated_at": "2022-09-04T14:36:35.093532Z",
"structure_string": "Nb2 Al2 V2 C2\n1.0\n3.048473 -0.000000 -0.000000\n-1.524236 2.640054 0.000000\n-0.000000 0.000000 13.495925\nNb Al V C\n2 2 2 2\ndirect\n0.333331 0.666666 0.404281 Nb\n0.666666 0.333332 0.595719 Nb\n0.333331 0.666666 0.764257 Al\n0.666666 0.333332 0.235744 Al\n0.666666 0.333332 0.921171 V\n0.333331 0.666666 0.078829 V\n0.000000 0.000000 0.500000 C\n0.000000 0.000000 0.000000 C\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Nb",
"Al",
"V",
"C"
],
"chemical_system": "Al-C-Nb-V",
"density": 5.590527245972668,
"density_atomic": 0.07365329287091621,
"volume": 108.6170039134665,
"volume_molar": 8.176336081204576,
"formula_full": "Nb2 Al2 V2 C2",
"formula_reduced": "NbAlVC",
"formula_anonymous": "ABCD",
"energy_above_hull": 4.2634916,
"spacegroup": 164
},
{
"id": "jvasp-92376",
"created_at": "2022-09-04T14:35:45.151844Z",
"updated_at": "2022-09-04T14:35:45.151866Z",
"structure_string": "Fe3 Pt1 N1\n1.0\n4.666659 -0.000000 0.000000\n-0.000000 4.666659 0.000000\n-0.000000 -0.000000 4.666659\nFe Pt N\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Fe\n0.500000 0.500000 0.000000 Fe\n0.500000 0.000000 0.500000 Fe\n0.500000 0.500000 0.500000 Pt\n0.000000 0.000000 0.000000 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Fe",
"Pt",
"N"
],
"chemical_system": "Fe-N-Pt",
"density": 6.1537641430138414,
"density_atomic": 0.04919849320675256,
"volume": 101.62912874156363,
"volume_molar": 12.240498371957159,
"formula_full": "Fe3 Pt1 N1",
"formula_reduced": "Fe3PtN",
"formula_anonymous": "ABC3",
"energy_above_hull": 4.26348023,
"spacegroup": 221
}
]
}