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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=elements&page=4408",
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"results": [
{
"id": "jvasp-11163",
"created_at": "2022-09-04T14:37:19.888730Z",
"updated_at": "2022-09-04T14:37:19.888762Z",
"structure_string": "Rb2 Na1 Rh1 F6\n1.0\n5.210392 -0.000000 3.008222\n1.736798 4.912405 3.008222\n-0.000000 -0.000000 6.016443\nRb Na Rh F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750001 0.749999 Rb\n0.500000 0.500001 0.499999 Na\n0.000000 0.000000 0.000000 Rh\n0.235469 0.764532 0.764530 F\n0.235469 0.764532 0.235468 F\n0.764531 0.235469 0.764531 F\n0.235468 0.235469 0.764531 F\n0.764531 0.235469 0.235468 F\n0.764531 0.764532 0.235468 F\n",
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],
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"volume": 153.99420199914488,
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"formula_full": "Rb2 Na1 Rh1 F6",
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{
"id": "jvasp-10887",
"created_at": "2022-09-04T14:37:15.167675Z",
"updated_at": "2022-09-04T14:37:15.167727Z",
"structure_string": "Rb3 Na1 Ru2 O8\n1.0\n3.027455 -5.243706 -0.000000\n3.027455 5.243706 0.000000\n0.000000 0.000000 7.938523\nRb Na Ru O\n3 1 2 8\ndirect\n0.666666 0.333332 0.649827 Rb\n0.000000 0.000000 0.000000 Rb\n0.333332 0.666666 0.350173 Rb\n0.000000 0.000000 0.500000 Na\n0.666666 0.333332 0.214967 Ru\n0.333332 0.666666 0.785033 Ru\n0.176096 0.823902 0.693905 O\n0.647804 0.823902 0.693905 O\n0.176097 0.352194 0.693905 O\n0.823902 0.176096 0.306095 O\n0.823902 0.647804 0.306095 O\n0.352194 0.176097 0.306095 O\n0.666666 0.333332 -0.006936 O\n0.333332 0.666666 0.006936 O\n",
"nsites": 14,
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"elements": [
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"O"
],
"chemical_system": "Na-O-Rb-Ru",
"density": 4.015663264399856,
"density_atomic": 0.05554465864133596,
"volume": 252.0494380999093,
"volume_molar": 10.841979962261147,
"formula_full": "Rb3 Na1 Ru2 O8",
"formula_reduced": "Rb3Na(RuO4)2",
"formula_anonymous": "AB2C3D8",
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"spacegroup": 164
},
{
"id": "jvasp-109256",
"created_at": "2022-09-04T14:38:15.628471Z",
"updated_at": "2022-09-04T14:38:15.628500Z",
"structure_string": "Rb2 Na1 Sb1 Br6\n1.0\n6.887678 -0.000000 3.976603\n2.295893 6.493765 3.976603\n-0.000000 -0.000000 7.953205\nRb Na Sb Br\n2 1 1 6\ndirect\n0.750000 0.749999 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Sb\n0.751327 0.248673 0.248673 Br\n0.248674 0.248673 0.751327 Br\n0.248673 0.751326 0.751327 Br\n0.248673 0.751326 0.248674 Br\n0.751327 0.248673 0.751327 Br\n0.751327 0.751326 0.248673 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
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"Na",
"Sb",
"Br"
],
"chemical_system": "Br-Na-Rb-Sb",
"density": 3.7116275355862176,
"density_atomic": 0.028111784792520998,
"volume": 355.7227004192367,
"volume_molar": 21.422121734519543,
"formula_full": "Rb2 Na1 Sb1 Br6",
"formula_reduced": "Rb2NaSbBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-38082",
"created_at": "2022-09-04T14:37:59.504716Z",
"updated_at": "2022-09-04T14:37:59.504741Z",
"structure_string": "Rb2 Na1 Sb1 Cl6\n1.0\n0.000000 5.323230 5.323230\n5.323230 0.000000 5.323230\n5.323230 5.323230 -0.000000\nRb Na Sb Cl\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Sb\n0.248423 0.751577 0.751577 Cl\n0.248423 0.751577 0.248423 Cl\n0.751577 0.248423 0.751577 Cl\n0.751577 0.751577 0.248423 Cl\n0.248423 0.248423 0.751577 Cl\n0.751577 0.248423 0.248423 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
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"Na",
"Sb",
"Cl"
],
"chemical_system": "Cl-Na-Rb-Sb",
"density": 2.90843248497757,
"density_atomic": 0.033147006320966815,
"volume": 301.68636959756446,
"volume_molar": 18.167977830899183,
"formula_full": "Rb2 Na1 Sb1 Cl6",
"formula_reduced": "Rb2NaSbCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-105684",
"created_at": "2022-09-04T14:35:43.910691Z",
"updated_at": "2022-09-04T14:35:43.910714Z",
"structure_string": "Rb2 Na1 Sb1 I6\n1.0\n7.415985 0.000000 4.281621\n2.471995 6.991859 4.281621\n0.000000 0.000000 8.563243\nRb Na Sb I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Sb\n0.751951 0.248049 0.248049 I\n0.248049 0.248049 0.751950 I\n0.248049 0.751951 0.751951 I\n0.248049 0.751951 0.248049 I\n0.751951 0.248049 0.751950 I\n0.751951 0.751951 0.248049 I\n",
"nsites": 10,
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"elements": [
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],
"chemical_system": "I-Na-Rb-Sb",
"density": 4.028192955335747,
"density_atomic": 0.022521651166227185,
"volume": 444.01717823405903,
"volume_molar": 26.73933947183512,
"formula_full": "Rb2 Na1 Sb1 I6",
"formula_reduced": "Rb2NaSbI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-100128",
"created_at": "2022-09-04T14:36:21.469157Z",
"updated_at": "2022-09-04T14:36:21.469167Z",
"structure_string": "Rb2 Na1 Sc1 Br6\n1.0\n6.685697 -0.000000 3.859988\n2.228566 6.303335 3.859988\n0.000000 0.000000 7.719978\nRb Na Sc Br\n2 1 1 6\ndirect\n0.750001 0.749999 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500001 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Sc\n0.758833 0.241167 0.241167 Br\n0.241168 0.241167 0.758833 Br\n0.241168 0.758832 0.758833 Br\n0.241168 0.758832 0.241167 Br\n0.758833 0.241167 0.758833 Br\n0.758834 0.758832 0.241167 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
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"Na",
"Sc",
"Br"
],
"chemical_system": "Br-Na-Rb-Sc",
"density": 3.6662748121055064,
"density_atomic": 0.03073738084123235,
"volume": 325.3367634559676,
"volume_molar": 19.592237839346613,
"formula_full": "Rb2 Na1 Sc1 Br6",
"formula_reduced": "Rb2NaScBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-109898",
"created_at": "2022-09-04T14:37:26.913485Z",
"updated_at": "2022-09-04T14:37:26.913511Z",
"structure_string": "Rb2 Na1 Sc1 Cl6\n1.0\n6.318418 -0.000000 3.647940\n2.106139 5.957061 3.647940\n-0.000000 -0.000000 7.295880\nRb Na Sc Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Sc\n0.759623 0.240377 0.240377 Cl\n0.240377 0.240377 0.759623 Cl\n0.240377 0.759623 0.759623 Cl\n0.240377 0.759623 0.240377 Cl\n0.759623 0.240377 0.759623 Cl\n0.759623 0.759623 0.240377 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
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"Na",
"Sc",
"Cl"
],
"chemical_system": "Cl-Na-Rb-Sc",
"density": 2.730764550345338,
"density_atomic": 0.036415134372378574,
"volume": 274.61109707136353,
"volume_molar": 16.53746680821775,
"formula_full": "Rb2 Na1 Sc1 Cl6",
"formula_reduced": "Rb2NaScCl6",
"formula_anonymous": "ABC2D6",
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"spacegroup": 225
},
{
"id": "jvasp-109251",
"created_at": "2022-09-04T14:38:17.551395Z",
"updated_at": "2022-09-04T14:38:17.551417Z",
"structure_string": "Rb2 Na1 Sc1 F6\n1.0\n5.263876 -0.000000 3.039100\n1.754625 4.962830 3.039100\n-0.000000 -0.000000 6.078201\nRb Na Sc F\n2 1 1 6\ndirect\n0.750001 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500001 0.500000 0.499999 Na\n0.000000 0.000000 0.000000 Sc\n0.763962 0.236038 0.236038 F\n0.236039 0.236038 0.763961 F\n0.236039 0.763962 0.763961 F\n0.236039 0.763962 0.236038 F\n0.763962 0.236038 0.763961 F\n0.763963 0.763962 0.236038 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
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"Sc",
"F"
],
"chemical_system": "F-Na-Rb-Sc",
"density": 3.69025027372612,
"density_atomic": 0.06297814918413004,
"volume": 158.78523153741577,
"volume_molar": 9.56227014927509,
"formula_full": "Rb2 Na1 Sc1 F6",
"formula_reduced": "Rb2NaScF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-110378",
"created_at": "2022-09-04T14:38:38.417425Z",
"updated_at": "2022-09-04T14:38:38.417453Z",
"structure_string": "Rb2 Na1 Sc1 I6\n1.0\n7.246852 0.000000 4.183972\n2.415617 6.832397 4.183972\n0.000000 0.000000 8.367944\nRb Na Sc I\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.499999 Na\n0.000000 0.000000 0.000000 Sc\n0.757926 0.242074 0.242073 I\n0.242074 0.242074 0.757926 I\n0.242074 0.757927 0.757926 I\n0.242074 0.757927 0.242073 I\n0.757926 0.242074 0.757926 I\n0.757926 0.757927 0.242073 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
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"Sc",
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],
"chemical_system": "I-Na-Rb-Sc",
"density": 4.009051480718845,
"density_atomic": 0.02413563611893678,
"volume": 414.32510627528137,
"volume_molar": 24.951241103917038,
"formula_full": "Rb2 Na1 Sc1 I6",
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"spacegroup": 225
},
{
"id": "jvasp-25583",
"created_at": "2022-09-04T14:38:18.649498Z",
"updated_at": "2022-09-04T14:38:18.649519Z",
"structure_string": "Rb4 Na4 Si8 O20\n1.0\n0.000000 4.910690 -0.001867\n13.708933 0.000000 0.000000\n0.000000 -0.134109 -7.706477\nRb Na Si O\n4 4 8 20\ndirect\n0.278308 0.802795 0.217104 Rb\n0.278308 0.697205 0.717104 Rb\n0.721692 0.302795 0.282896 Rb\n0.721692 0.197205 0.782896 Rb\n0.227620 0.092627 0.033032 Na\n0.227620 0.407373 0.533033 Na\n0.772380 0.907373 0.966968 Na\n0.772380 0.592627 0.466968 Na\n0.796466 0.868990 0.518705 Si\n0.301187 0.954016 0.714395 Si\n0.698813 0.454016 0.785606 Si\n0.203534 0.368990 0.981296 Si\n0.203534 0.131010 0.481296 Si\n0.796466 0.631010 0.018704 Si\n0.301187 0.545983 0.214395 Si\n0.698813 0.045984 0.285606 Si\n0.251936 0.071799 0.669927 O\n0.244292 0.931317 0.912978 O\n0.729305 0.756690 0.499334 O\n0.755708 0.431317 0.587023 O\n0.270695 0.256690 0.000667 O\n0.122084 0.611570 0.072072 O\n0.251936 0.428201 0.169927 O\n0.375419 0.429820 0.831432 O\n0.122084 0.888430 0.572072 O\n0.755708 0.068683 0.087023 O\n0.748064 0.928201 0.330073 O\n0.748064 0.571798 0.830073 O\n0.375420 0.070180 0.331431 O\n0.244292 0.568683 0.412977 O\n0.877916 0.111570 0.427929 O\n0.624580 0.570180 0.168569 O\n0.877916 0.388430 0.927929 O\n0.624580 0.929820 0.668569 O\n0.729305 0.743309 -0.000666 O\n0.270695 0.243310 0.500667 O\n",
"nsites": 36,
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"elements": [
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],
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"density": 3.131886431381304,
"density_atomic": 0.06939010871401546,
"volume": 518.8059316691731,
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"formula_full": "Rb4 Na4 Si8 O20",
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"spacegroup": 14
},
{
"id": "jvasp-106461",
"created_at": "2022-09-04T14:36:43.136342Z",
"updated_at": "2022-09-04T14:36:43.136366Z",
"structure_string": "Rb2 Na1 Sm1 Cl6\n1.0\n6.548246 -0.000000 3.780632\n2.182749 6.173746 3.780632\n-0.000000 -0.000000 7.561263\nRb Na Sm Cl\n2 1 1 6\ndirect\n0.750000 0.750001 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.499999 Na\n0.000000 0.000000 0.000000 Sm\n0.750047 0.249953 0.249953 Cl\n0.249953 0.249953 0.750046 Cl\n0.249953 0.750047 0.750046 Cl\n0.249953 0.750047 0.249953 Cl\n0.750047 0.249953 0.750046 Cl\n0.750047 0.750047 0.249952 Cl\n",
"nsites": 10,
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"elements": [
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],
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"density": 3.025790335308907,
"density_atomic": 0.03271386910877912,
"volume": 305.680748637476,
"volume_molar": 18.408524959170585,
"formula_full": "Rb2 Na1 Sm1 Cl6",
"formula_reduced": "Rb2NaSmCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-107630",
"created_at": "2022-09-04T14:36:54.090832Z",
"updated_at": "2022-09-04T14:36:54.090840Z",
"structure_string": "Rb2 Na1 Ta1 Br6\n1.0\n6.670978 -0.000000 3.851491\n2.223659 6.289459 3.851491\n0.000000 -0.000000 7.702982\nRb Na Ta Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Ta\n0.759067 0.240933 0.240933 Br\n0.240933 0.240933 0.759067 Br\n0.240933 0.759067 0.759066 Br\n0.240933 0.759067 0.240933 Br\n0.759067 0.240933 0.759066 Br\n0.759067 0.759067 0.240933 Br\n",
"nsites": 10,
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"elements": [
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"Br"
],
"chemical_system": "Br-Na-Rb-Ta",
"density": 4.38931170997248,
"density_atomic": 0.03094128301171869,
"volume": 323.192803485641,
"volume_molar": 19.463125552095487,
"formula_full": "Rb2 Na1 Ta1 Br6",
"formula_reduced": "Rb2NaTaBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.2987232829999999,
"spacegroup": 225
}
]
}