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=volume&page=4407",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume&page=4405",
"results": [
{
"id": "jvasp-20349",
"created_at": "2022-09-04T14:38:29.186413Z",
"updated_at": "2022-09-04T14:38:29.186438Z",
"structure_string": "Na2 Zn26\n1.0\n7.524486 0.000000 4.344264\n2.508162 7.094153 4.344264\n0.000000 0.000000 8.688528\nNa Zn\n2 26\ndirect\n0.250000 0.250000 0.250000 Na\n0.750000 0.750000 0.750000 Na\n0.801357 0.198644 0.559744 Zn\n0.559744 0.440256 0.801356 Zn\n0.440256 0.559744 0.198643 Zn\n0.301356 0.059744 0.698644 Zn\n0.059744 0.698644 0.301356 Zn\n0.698644 0.301356 0.059743 Zn\n0.301356 0.698644 0.940256 Zn\n0.301356 0.940256 0.059744 Zn\n0.940256 0.698644 0.059743 Zn\n0.198644 0.559744 0.801356 Zn\n0.198644 0.440256 0.559744 Zn\n0.440256 0.801356 0.559744 Zn\n0.559744 0.801356 0.198643 Zn\n0.801357 0.559744 0.440255 Zn\n0.559744 0.198644 0.440256 Zn\n0.801357 0.440256 0.198643 Zn\n0.440256 0.198644 0.801356 Zn\n0.940256 0.059744 0.301356 Zn\n0.059744 0.940256 0.698644 Zn\n0.059744 0.301356 0.940256 Zn\n0.698644 0.940256 0.301356 Zn\n0.940256 0.301356 0.698643 Zn\n0.698644 0.059744 0.940256 Zn\n0.198644 0.801356 0.440256 Zn\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Zn\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Na",
"Zn"
],
"chemical_system": "Na-Zn",
"density": 6.253488066894832,
"density_atomic": 0.0603718434398912,
"volume": 463.79236419835354,
"volume_molar": 9.975081787913107,
"formula_full": "Na2 Zn26",
"formula_reduced": "NaZn13",
"formula_anonymous": "AB13",
"energy_above_hull": 0.0,
"spacegroup": 226
},
{
"id": "jvasp-29407",
"created_at": "2022-09-04T14:36:40.026730Z",
"updated_at": "2022-09-04T14:36:40.026756Z",
"structure_string": "Hg6 As2 S8 Br2\n1.0\n7.572386 -0.000000 -0.000000\n-3.786193 6.557878 0.000000\n-0.000000 -0.000000 9.340316\nHg As S Br\n6 2 8 2\ndirect\n0.495588 0.991175 0.245249 Hg\n0.991175 0.495587 0.745249 Hg\n0.008826 0.504413 0.245249 Hg\n0.504413 0.495587 0.745249 Hg\n0.504413 0.008826 0.745249 Hg\n0.495588 0.504413 0.245249 Hg\n0.000000 0.000000 0.728365 As\n0.000000 0.000000 0.228364 As\n0.333334 0.666667 0.104647 S\n0.148488 0.851513 0.862566 S\n0.851513 0.703026 0.362566 S\n0.296974 0.148488 0.362566 S\n0.703027 0.851513 0.862566 S\n0.851513 0.148488 0.362566 S\n0.666668 0.333333 0.604648 S\n0.148488 0.296974 0.862566 S\n0.666668 0.333333 0.023549 Br\n0.333334 0.666667 0.523549 Br\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Hg",
"As",
"S",
"Br"
],
"chemical_system": "As-Br-Hg-S",
"density": 6.335688995410805,
"density_atomic": 0.03880742785559473,
"volume": 463.82873059712466,
"volume_molar": 15.518010578822242,
"formula_full": "Hg6 As2 S8 Br2",
"formula_reduced": "Hg3AsS4Br",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.6104788505555556,
"spacegroup": 186
},
{
"id": "jvasp-86746",
"created_at": "2022-09-04T14:36:00.922126Z",
"updated_at": "2022-09-04T14:36:00.922162Z",
"structure_string": "Er10 Bi2 Au4\n1.0\n6.546248 -0.000000 -3.361977\n-1.726620 6.314439 -3.361977\n0.948410 1.242560 9.900917\nEr Bi Au\n10 2 4\ndirect\n0.503197 0.326422 0.329618 Er\n0.326422 0.826422 0.329618 Er\n0.673578 0.173578 0.670382 Er\n0.496804 0.673578 0.670382 Er\n0.000000 0.000000 0.000000 Er\n0.996804 0.496804 0.670382 Er\n0.003196 0.503196 0.329618 Er\n0.826422 0.003196 0.329618 Er\n0.173578 0.996804 0.670382 Er\n0.500000 0.500000 -0.000000 Er\n0.250000 0.250000 0.500000 Bi\n0.750000 0.750000 0.500000 Bi\n0.129172 0.629172 -0.000000 Au\n0.870829 0.370828 -0.000000 Au\n0.370829 0.129172 -0.000000 Au\n0.629172 0.870829 -0.000000 Au\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Er",
"Bi",
"Au"
],
"chemical_system": "Au-Bi-Er",
"density": 10.302094968462114,
"density_atomic": 0.03448599110209367,
"volume": 463.956507807271,
"volume_molar": 17.462571228333907,
"formula_full": "Er10 Bi2 Au4",
"formula_reduced": "Er5BiAu2",
"formula_anonymous": "AB2C5",
"energy_above_hull": 1.20871243,
"spacegroup": 140
},
{
"id": "jvasp-86144",
"created_at": "2022-09-04T14:35:56.136551Z",
"updated_at": "2022-09-04T14:35:56.136585Z",
"structure_string": "Er10 Bi2 Au4\n1.0\n6.546295 -0.000000 -3.362001\n-1.726632 6.314484 -3.362001\n0.948358 1.242492 9.900873\nEr Bi Au\n10 2 4\ndirect\n0.503198 0.326421 0.329619 Er\n0.326422 0.826421 0.329619 Er\n0.673579 0.173578 0.670381 Er\n0.496803 0.673578 0.670381 Er\n0.000000 0.000000 0.000000 Er\n0.996804 0.496802 0.670381 Er\n0.003198 0.503197 0.329619 Er\n0.826422 0.003197 0.329619 Er\n0.173579 0.996802 0.670381 Er\n0.500000 0.500000 0.000000 Er\n0.250000 0.250000 0.500000 Bi\n0.750001 0.749999 0.500000 Bi\n0.129173 0.629172 0.000000 Au\n0.870828 0.370827 0.000000 Au\n0.370828 0.129173 0.000000 Au\n0.629173 0.870827 0.000000 Au\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Er",
"Bi",
"Au"
],
"chemical_system": "Au-Bi-Er",
"density": 10.302054525412405,
"density_atomic": 0.03448585572005179,
"volume": 463.95832917368506,
"volume_molar": 17.462639781614662,
"formula_full": "Er10 Bi2 Au4",
"formula_reduced": "Er5BiAu2",
"formula_anonymous": "AB2C5",
"energy_above_hull": 1.20871243,
"spacegroup": 140
},
{
"id": "jvasp-102903",
"created_at": "2022-09-04T14:36:54.067095Z",
"updated_at": "2022-09-04T14:36:54.067109Z",
"structure_string": "Rb2 Y1 Hg1 I6\n1.0\n7.525578 0.000000 4.344895\n2.508526 7.095183 4.344895\n-0.000000 -0.000000 8.689789\nRb Y Hg I\n2 1 1 6\ndirect\n0.750001 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 Hg\n0.756206 0.243794 0.243794 I\n0.243794 0.243794 0.756206 I\n0.243795 0.756206 0.756207 I\n0.243795 0.756206 0.243794 I\n0.756206 0.243794 0.756207 I\n0.756207 0.756206 0.243795 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Y",
"Hg",
"I"
],
"chemical_system": "Hg-I-Rb-Y",
"density": 4.372776053637423,
"density_atomic": 0.021551986480446837,
"volume": 463.9943519393239,
"volume_molar": 27.942392992235877,
"formula_full": "Rb2 Y1 Hg1 I6",
"formula_reduced": "Rb2YHgI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-111999",
"created_at": "2022-09-04T14:38:45.174679Z",
"updated_at": "2022-09-04T14:38:45.174706Z",
"structure_string": "Y10 Tl6\n1.0\n8.977982 -0.000000 0.000000\n-4.488991 7.775161 -0.000000\n-0.000000 0.000000 6.647080\nY Tl\n10 6\ndirect\n0.666667 0.333333 0.000000 Y\n0.333333 0.666667 0.000000 Y\n0.333333 0.666667 0.500000 Y\n0.666667 0.333333 0.500000 Y\n0.762795 0.762795 0.750000 Y\n0.237205 0.000000 0.750000 Y\n0.000000 0.237205 0.750000 Y\n0.237205 0.237205 0.250000 Y\n0.762795 0.000000 0.250000 Y\n0.000000 0.762795 0.250000 Y\n0.400850 0.400850 0.750000 Tl\n0.599150 0.000000 0.750000 Tl\n0.000000 0.599150 0.750000 Tl\n0.599150 0.599150 0.250000 Tl\n0.400850 0.000000 0.250000 Tl\n0.000000 0.400850 0.250000 Tl\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Y",
"Tl"
],
"chemical_system": "Tl-Y",
"density": 7.570316024113193,
"density_atomic": 0.03448267555290124,
"volume": 464.0011177628535,
"volume_molar": 17.46425027478275,
"formula_full": "Y10 Tl6",
"formula_reduced": "Y5Tl3",
"formula_anonymous": "A3B5",
"energy_above_hull": 1.79138188125,
"spacegroup": 193
},
{
"id": "jvasp-26464",
"created_at": "2022-09-04T14:37:57.208662Z",
"updated_at": "2022-09-04T14:37:57.208687Z",
"structure_string": "Sm4 Se4 Cl4 O12\n1.0\n7.123052 -0.000000 0.000000\n0.000000 7.196277 0.000000\n0.000000 0.000000 9.052771\nSm Se Cl O\n4 4 4 12\ndirect\n0.250000 0.109204 0.539297 Sm\n0.750000 0.390796 0.039297 Sm\n0.750000 0.890796 0.460703 Sm\n0.250000 0.609204 0.960703 Sm\n0.750000 0.798802 0.868480 Se\n0.250000 0.701199 0.368480 Se\n0.750000 0.298802 0.631520 Se\n0.250000 0.201199 0.131520 Se\n0.250000 0.458332 0.676983 Cl\n0.750000 0.041669 0.176983 Cl\n0.750000 0.541669 0.323017 Cl\n0.250000 0.958332 0.823017 Cl\n0.425573 0.350010 0.065323 O\n0.425573 0.850011 0.434677 O\n0.574427 0.149990 0.565323 O\n0.250000 0.752370 0.185270 O\n0.750000 0.247631 0.814730 O\n0.574427 0.649990 0.934677 O\n0.925573 0.149990 0.565323 O\n0.074427 0.350010 0.065323 O\n0.750000 0.747631 0.685270 O\n0.925573 0.649990 0.934677 O\n0.074427 0.850011 0.434677 O\n0.250000 0.252370 0.314730 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Sm",
"Se",
"Cl",
"O"
],
"chemical_system": "Cl-O-Se-Sm",
"density": 4.476930205633426,
"density_atomic": 0.05171966705439109,
"volume": 464.0401102110799,
"volume_molar": 11.643811924904318,
"formula_full": "Sm4 Se4 Cl4 O12",
"formula_reduced": "SmSeClO3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 1.5436094681944446,
"spacegroup": 62
},
{
"id": "jvasp-122046",
"created_at": "2022-09-04T14:38:52.232976Z",
"updated_at": "2022-09-04T14:38:52.233004Z",
"structure_string": "Ho8 Sn4 Au8\n1.0\n7.890231 0.000000 0.000000\n0.000000 7.890231 0.000000\n-0.000000 -0.000000 7.453818\nHo Sn Au\n8 4 8\ndirect\n0.839950 0.160050 0.500000 Ho\n0.160050 0.839950 0.500000 Ho\n0.339950 0.339950 -0.000000 Ho\n0.660050 0.660050 -0.000000 Ho\n0.679131 0.679131 0.500000 Ho\n0.320869 0.320869 0.500000 Ho\n0.179131 0.820869 -0.000000 Ho\n0.820869 0.179131 -0.000000 Ho\n-0.000000 0.500000 0.250000 Sn\n0.500000 -0.000000 0.750000 Sn\n-0.000000 0.500000 0.750000 Sn\n0.500000 -0.000000 0.250000 Sn\n0.628249 0.371751 0.269641 Au\n0.371751 0.628249 0.269641 Au\n0.128249 0.128249 0.769642 Au\n0.871751 0.871751 0.769642 Au\n0.371751 0.628249 0.730359 Au\n0.628249 0.371751 0.730359 Au\n0.871751 0.871751 0.230359 Au\n0.128249 0.128249 0.230359 Au\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Ho",
"Sn",
"Au"
],
"chemical_system": "Au-Ho-Sn",
"density": 12.059317381693187,
"density_atomic": 0.043099454663316626,
"volume": 464.0429944238404,
"volume_molar": 13.972661155561314,
"formula_full": "Ho8 Sn4 Au8",
"formula_reduced": "Ho2SnAu2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.6871395946666666,
"spacegroup": 136
},
{
"id": "jvasp-117362",
"created_at": "2022-09-04T14:38:26.328437Z",
"updated_at": "2022-09-04T14:38:26.328460Z",
"structure_string": "Ba6 Nd2 Ir4 O18\n1.0\n5.985205 -0.000785 0.076988\n-2.981640 5.189653 0.076988\n-0.016011 -0.027661 14.944945\nBa Nd Ir O\n6 2 4 18\ndirect\n0.997253 0.002750 0.750000 Ba\n0.002749 0.997251 0.250000 Ba\n0.328034 0.660782 0.596722 Ba\n0.671967 0.339218 0.403278 Ba\n0.339218 0.671966 0.903278 Ba\n0.660783 0.328034 0.096722 Ba\n0.000000 0.000000 0.500000 Nd\n0.000000 0.000000 0.000000 Nd\n0.322504 0.654551 0.166006 Ir\n0.677497 0.345449 0.833994 Ir\n0.345449 0.677496 0.333994 Ir\n0.654552 0.322504 0.666006 Ir\n0.495227 0.982198 0.242378 O\n0.504774 0.017803 0.757622 O\n0.201678 0.383551 0.419624 O\n0.798323 0.616449 0.580376 O\n0.616449 0.798322 0.080376 O\n0.383552 0.201678 0.919624 O\n0.493487 0.506514 0.250000 O\n0.506515 0.493486 0.750000 O\n0.846085 0.199806 0.908211 O\n0.845950 0.666256 0.902177 O\n0.666257 0.845949 0.402178 O\n0.333745 0.154052 0.597822 O\n0.153916 0.800194 0.091789 O\n0.982199 0.495227 0.742378 O\n0.199806 0.846084 0.408211 O\n0.800196 0.153917 0.591789 O\n0.154052 0.333744 0.097823 O\n0.017802 0.504773 0.257622 O\n",
"nsites": 30,
"nelements": 4,
"elements": [
"Ba",
"Nd",
"Ir",
"O"
],
"chemical_system": "Ba-Ir-Nd-O",
"density": 7.760086427441444,
"density_atomic": 0.06462766402405289,
"volume": 464.19749890441204,
"volume_molar": 9.318208929474384,
"formula_full": "Ba6 Nd2 Ir4 O18",
"formula_reduced": "Ba3NdIr2O9",
"formula_anonymous": "AB2C3D9",
"energy_above_hull": 2.484123540666667,
"spacegroup": 15
},
{
"id": "jvasp-55181",
"created_at": "2022-09-04T14:38:36.486070Z",
"updated_at": "2022-09-04T14:38:36.486087Z",
"structure_string": "Dy10 Sb2 Au4\n1.0\n6.527825 -0.000000 -3.379406\n-1.749494 6.289020 -3.379406\n0.990033 1.303035 9.906829\nDy Sb Au\n10 2 4\ndirect\n0.670457 0.170457 0.667226 Dy\n0.170457 0.996769 0.667226 Dy\n0.503231 0.329543 0.332774 Dy\n0.496769 0.670457 0.667226 Dy\n0.829543 0.003231 0.332774 Dy\n0.000000 0.000000 0.000000 Dy\n0.996770 0.496769 0.667226 Dy\n0.500001 0.500000 -0.000000 Dy\n0.329544 0.829543 0.332774 Dy\n0.003231 0.503231 0.332774 Dy\n0.250000 0.250000 0.500000 Sb\n0.750001 0.750000 0.500000 Sb\n0.371564 0.128436 -0.000000 Au\n0.628437 0.871564 -0.000000 Au\n0.871565 0.371564 -0.000000 Au\n0.128437 0.628436 -0.000000 Au\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Dy",
"Sb",
"Au"
],
"chemical_system": "Au-Dy-Sb",
"density": 9.502408842947395,
"density_atomic": 0.03446778453756693,
"volume": 464.2015787977719,
"volume_molar": 17.471795303340087,
"formula_full": "Dy10 Sb2 Au4",
"formula_reduced": "Dy5SbAu2",
"formula_anonymous": "AB2C5",
"energy_above_hull": 1.3312804675,
"spacegroup": 140
},
{
"id": "jvasp-119069",
"created_at": "2022-09-04T14:38:50.591237Z",
"updated_at": "2022-09-04T14:38:50.591269Z",
"structure_string": "Tm4 Al18 Ir6\n1.0\n7.515828 0.007054 0.000000\n-3.716026 6.532907 0.000000\n0.000000 0.000000 9.449412\nTm Al Ir\n4 18 6\ndirect\n0.995702 0.671777 0.250000 Tm\n0.004298 0.328223 0.750000 Tm\n0.671777 0.995702 0.250000 Tm\n0.328223 0.004298 0.750000 Tm\n0.450892 0.660739 0.750000 Al\n0.549108 0.339261 0.250000 Al\n0.660739 0.450892 0.750000 Al\n0.339261 0.549108 0.250000 Al\n0.333047 0.333047 0.943939 Al\n0.666952 0.666952 0.056061 Al\n0.666952 0.666952 0.443939 Al\n0.333047 0.333047 0.556061 Al\n0.335303 0.000717 0.075243 Al\n0.664696 0.999283 0.575243 Al\n0.000717 0.335304 0.424757 Al\n0.335303 0.000717 0.424757 Al\n0.999283 0.664696 0.575243 Al\n0.999283 0.664696 0.924757 Al\n0.000717 0.335304 0.075243 Al\n0.871217 0.871217 0.750000 Al\n0.128783 0.128783 0.250000 Al\n0.664696 0.999283 0.924757 Al\n0.000000 0.000000 0.000000 Ir\n0.672089 0.327910 -0.000000 Ir\n0.327910 0.672090 -0.000000 Ir\n0.327910 0.672090 0.500000 Ir\n0.672089 0.327910 0.500000 Ir\n0.000000 0.000000 0.500000 Ir\n",
"nsites": 28,
"nelements": 3,
"elements": [
"Tm",
"Al",
"Ir"
],
"chemical_system": "Al-Ir-Tm",
"density": 8.279901100222709,
"density_atomic": 0.060316779549200006,
"volume": 464.2157656504287,
"volume_molar": 9.984188156278766,
"formula_full": "Tm4 Al18 Ir6",
"formula_reduced": "Tm2(Al3Ir)3",
"formula_anonymous": "A2B3C9",
"energy_above_hull": 2.741759071428572,
"spacegroup": 63
},
{
"id": "jvasp-29737",
"created_at": "2022-09-04T14:37:05.181232Z",
"updated_at": "2022-09-04T14:37:05.181252Z",
"structure_string": "V8 Pb4 O24\n1.0\n3.653534 0.000000 0.000000\n0.000000 9.859009 0.000000\n0.000000 0.000000 12.887855\nV Pb O\n8 4 24\ndirect\n0.250000 0.239163 0.406046 V\n0.250000 0.006825 0.630622 V\n0.749999 0.993175 0.369378 V\n0.749999 0.760837 0.593954 V\n0.749999 0.260837 0.906046 V\n0.250000 0.506825 0.869378 V\n0.250000 0.739163 0.093954 V\n0.749999 0.493175 0.130622 V\n0.749999 0.370873 0.618406 Pb\n0.250000 0.129127 0.118406 Pb\n0.749999 0.870873 0.881594 Pb\n0.250000 0.629127 0.381594 Pb\n0.250000 0.483132 0.740632 O\n0.749999 0.969654 0.594575 O\n0.250000 0.530346 0.094574 O\n0.749999 0.324901 0.103053 O\n0.250000 0.276958 0.282283 O\n0.749999 0.516868 0.259369 O\n0.250000 0.675099 0.896947 O\n0.250000 0.776958 0.217717 O\n0.250000 0.892005 0.028296 O\n0.250000 0.812053 0.572053 O\n0.749999 0.223042 0.782283 O\n0.749999 0.824902 0.396947 O\n0.749999 0.107995 0.971705 O\n0.749999 0.723042 0.717717 O\n0.250000 0.983132 0.759369 O\n0.250000 0.312053 0.927947 O\n0.250000 0.175099 0.603053 O\n0.749999 0.687947 0.072053 O\n0.749999 0.469654 0.905426 O\n0.749999 0.607995 0.528296 O\n0.749999 0.187947 0.427947 O\n0.749999 0.016868 0.240632 O\n0.250000 0.392005 0.471704 O\n0.250000 0.030346 0.405426 O\n",
"nsites": 36,
"nelements": 3,
"elements": [
"V",
"Pb",
"O"
],
"chemical_system": "O-Pb-V",
"density": 5.795917422966879,
"density_atomic": 0.07754886451854752,
"volume": 464.2234315550785,
"volume_molar": 7.765607913652524,
"formula_full": "V8 Pb4 O24",
"formula_reduced": "V2PbO6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.8286333577777785,
"spacegroup": 62
}
]
}