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=density&page=1136",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density&page=1134",
"results": [
{
"id": "jvasp-24261",
"created_at": "2022-09-04T14:37:59.079453Z",
"updated_at": "2022-09-04T14:37:59.079480Z",
"structure_string": "Rb4 Mo6 O20\n1.0\n8.088529 0.000000 0.000000\n-4.044265 7.019632 -1.043394\n0.000000 -0.002111 9.223810\nRb Mo O\n4 6 20\ndirect\n0.769777 0.365342 0.156627 Rb\n0.404435 0.634658 0.343373 Rb\n0.230222 0.634658 0.843373 Rb\n0.595564 0.365342 0.656627 Rb\n0.293677 0.000000 0.250000 Mo\n0.817631 0.783482 0.977579 Mo\n0.706324 0.000000 0.750000 Mo\n0.182369 0.216518 0.022421 Mo\n0.965851 0.783482 0.477579 Mo\n0.034149 0.216518 0.522421 Mo\n0.949338 0.282479 0.382757 O\n0.478969 0.104305 0.384025 O\n0.374663 0.895695 0.115976 O\n0.856544 0.595953 0.917313 O\n0.260591 0.404047 0.582688 O\n0.143456 0.404047 0.082688 O\n0.739408 0.595952 0.417313 O\n0.666858 0.717521 0.117244 O\n0.333142 0.282479 0.882756 O\n0.891618 0.949709 0.592214 O\n0.058090 0.949709 0.092214 O\n0.108381 0.050291 0.407786 O\n0.941910 0.050291 0.907786 O\n0.625336 0.104305 0.884025 O\n0.648866 0.759690 0.818588 O\n0.889177 0.240310 0.681413 O\n0.351133 0.240310 0.181413 O\n0.110823 0.759690 0.318588 O\n0.050662 0.717521 0.617244 O\n0.521031 0.895695 0.615976 O\n",
"nsites": 30,
"nelements": 3,
"elements": [
"Rb",
"Mo",
"O"
],
"chemical_system": "Mo-O-Rb",
"density": 3.9238695261031262,
"density_atomic": 0.05728511489518597,
"volume": 523.6962525935527,
"volume_molar": 10.51257516200963,
"formula_full": "Rb4 Mo6 O20",
"formula_reduced": "Rb2Mo3O10",
"formula_anonymous": "A2B3C10",
"energy_above_hull": 3.1800735133333333,
"spacegroup": 15
},
{
"id": "jvasp-38925",
"created_at": "2022-09-04T14:37:53.723404Z",
"updated_at": "2022-09-04T14:37:53.723436Z",
"structure_string": "Mg2 Ti6\n1.0\n2.944719 -5.100404 -0.000000\n2.944719 5.100404 0.000000\n0.000000 0.000000 4.730941\nMg Ti\n2 6\ndirect\n0.333333 0.666667 0.750000 Mg\n0.666667 0.333333 0.250000 Mg\n0.834968 0.669936 0.750000 Ti\n0.834968 0.165032 0.750000 Ti\n0.330064 0.165032 0.750000 Ti\n0.669936 0.834968 0.250000 Ti\n0.165032 0.834968 0.250000 Ti\n0.165032 0.330064 0.250000 Ti\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mg",
"Ti"
],
"chemical_system": "Mg-Ti",
"density": 3.9239127757887067,
"density_atomic": 0.05629424814819734,
"volume": 142.11043335972107,
"volume_molar": 10.697612914460501,
"formula_full": "Mg2 Ti6",
"formula_reduced": "MgTi3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.775921666666666,
"spacegroup": 194
},
{
"id": "jvasp-71414",
"created_at": "2022-09-04T14:36:11.396328Z",
"updated_at": "2022-09-04T14:36:11.396358Z",
"structure_string": "Be2 Fe1 Cl1\n1.0\n2.888750 -0.000000 0.000000\n-0.000000 2.888750 -0.000000\n0.000000 -0.000000 5.543800\nBe Fe Cl\n2 1 1\ndirect\n0.000000 0.000000 0.180835 Be\n0.000000 0.000000 0.819165 Be\n0.500000 0.500000 0.000000 Fe\n0.500000 0.500000 0.500000 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Fe",
"Cl"
],
"chemical_system": "Be-Cl-Fe",
"density": 3.9240148361440252,
"density_atomic": 0.08646344199345714,
"volume": 46.262326687187496,
"volume_molar": 6.96495607988369,
"formula_full": "Be2 Fe1 Cl1",
"formula_reduced": "Be2FeCl",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.832407941875,
"spacegroup": 123
},
{
"id": "jvasp-29887",
"created_at": "2022-09-04T14:37:31.827819Z",
"updated_at": "2022-09-04T14:37:31.827831Z",
"structure_string": "Co1 Cl2\n1.0\n0.525329 3.728013 11.851204\n-2.132368 2.558130 4.355898\n-1.003490 -3.314254 -5.436561\nCo Cl\n1 2\ndirect\n0.000000 0.000000 0.000000 Co\n0.333061 0.103090 0.000000 Cl\n0.666940 0.896910 0.000001 Cl\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Co",
"Cl"
],
"chemical_system": "Cl-Co",
"density": 3.9241801006552586,
"density_atomic": 0.054602845331651134,
"volume": 54.94219178100261,
"volume_molar": 11.02898708560376,
"formula_full": "Co1 Cl2",
"formula_reduced": "CoCl2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.8850630116666666,
"spacegroup": 164
},
{
"id": "jvasp-99672",
"created_at": "2022-09-04T14:36:33.878617Z",
"updated_at": "2022-09-04T14:36:33.878640Z",
"structure_string": "Rb2 In1 As1 Br6\n1.0\n6.886187 0.000000 3.975742\n2.295395 6.492359 3.975742\n-0.000000 -0.000000 7.951483\nRb In As Br\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 In\n0.000000 0.000000 0.000000 As\n0.761759 0.238242 0.238241 Br\n0.238242 0.238242 0.761758 Br\n0.238242 0.761758 0.761757 Br\n0.238242 0.761758 0.238241 Br\n0.761759 0.238242 0.761758 Br\n0.761759 0.761758 0.238241 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"In",
"As",
"Br"
],
"chemical_system": "As-Br-In-Rb",
"density": 3.9241915224292807,
"density_atomic": 0.028130051457535672,
"volume": 355.49170662185657,
"volume_molar": 21.408210962894447,
"formula_full": "Rb2 In1 As1 Br6",
"formula_reduced": "Rb2InAsBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-100673",
"created_at": "2022-09-04T14:36:36.468878Z",
"updated_at": "2022-09-04T14:36:36.468903Z",
"structure_string": "K2 Li1 Sb1 I6\n1.0\n7.219755 -0.000000 4.168327\n2.406585 6.806850 4.168327\n-0.000000 -0.000000 8.336655\nK Li Sb I\n2 1 1 6\ndirect\n0.749999 0.750000 0.750001 K\n0.250000 0.250000 0.250000 K\n0.499999 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Sb\n0.745520 0.254480 0.254480 I\n0.254479 0.254480 0.745520 I\n0.254479 0.745520 0.745520 I\n0.254479 0.745520 0.254480 I\n0.745520 0.254480 0.745520 I\n0.745519 0.745520 0.254481 I\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"Li",
"Sb",
"I"
],
"chemical_system": "I-K-Li-Sb",
"density": 3.924727533660576,
"density_atomic": 0.024408412276248768,
"volume": 409.69481696811374,
"volume_molar": 24.67239856424417,
"formula_full": "K2 Li1 Sb1 I6",
"formula_reduced": "K2LiSbI6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-47845",
"created_at": "2022-09-04T14:36:46.123818Z",
"updated_at": "2022-09-04T14:36:46.123830Z",
"structure_string": "Li6 Fe2 Si2 O10\n1.0\n4.980391 -0.003708 0.013668\n1.582554 5.386463 0.006629\n1.493537 1.081960 5.830725\nLi Fe Si O\n6 2 2 10\ndirect\n0.494156 0.249755 0.003142 Li\n0.317352 0.448640 0.397303 Li\n0.307429 0.948401 0.396231 Li\n0.692571 0.051598 0.603771 Li\n0.682647 0.551359 0.602699 Li\n0.505843 0.750244 -0.003142 Li\n0.905742 0.350126 0.204247 Fe\n0.094257 0.649873 0.795754 Fe\n0.101854 0.150497 0.780477 Si\n0.898146 0.849502 0.219525 Si\n0.353041 0.336630 0.718501 O\n0.645675 0.127302 0.284994 O\n0.646958 0.663369 0.281500 O\n0.159062 0.048401 0.096494 O\n0.002764 0.752919 0.485075 O\n0.163955 0.577132 0.104657 O\n0.836044 0.422867 0.895344 O\n-0.002764 0.247080 0.514926 O\n0.840938 0.951598 0.903507 O\n0.354325 0.872697 0.715008 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Li",
"Fe",
"Si",
"O"
],
"chemical_system": "Fe-Li-O-Si",
"density": 3.9248196334095287,
"density_atomic": 0.1279337068000997,
"volume": 156.33096624997046,
"volume_molar": 4.707235419520657,
"formula_full": "Li6 Fe2 Si2 O10",
"formula_reduced": "Li3FeSiO5",
"formula_anonymous": "ABC3D5",
"energy_above_hull": 2.25653116,
"spacegroup": 2
},
{
"id": "jvasp-119514",
"created_at": "2022-09-04T14:38:44.459557Z",
"updated_at": "2022-09-04T14:38:44.459587Z",
"structure_string": "Mg6 Cr4 N8\n1.0\n6.173331 0.007079 -0.066961\n-4.279837 5.868697 0.000000\n-0.017896 -0.013051 5.435834\nMg Cr N\n6 4 8\ndirect\n0.225375 0.990553 0.974523 Mg\n0.774624 0.765177 0.525476 Mg\n0.774624 0.009448 0.025477 Mg\n0.225375 0.234824 0.474523 Mg\n-0.000000 0.595509 0.749999 Mg\n-0.000000 0.404492 0.250000 Mg\n0.610302 0.433585 0.102515 Cr\n0.389698 0.823283 0.397484 Cr\n0.610301 0.176718 0.602515 Cr\n0.389698 0.566416 0.897484 Cr\n0.291324 0.735535 0.063883 N\n0.220037 0.945071 0.569953 N\n0.779962 0.725035 0.930045 N\n0.779963 0.054930 0.430046 N\n0.220037 0.274966 0.069954 N\n0.708675 0.264466 0.936116 N\n0.291324 0.555790 0.563883 N\n0.708676 0.444211 0.436116 N\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Mg",
"Cr",
"N"
],
"chemical_system": "Cr-Mg-N",
"density": 3.925050511402054,
"density_atomic": 0.09132838490794604,
"volume": 197.0909703280421,
"volume_molar": 6.59394203244696,
"formula_full": "Mg6 Cr4 N8",
"formula_reduced": "Mg3(CrN2)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 3.560246105555556,
"spacegroup": 15
},
{
"id": "jvasp-101499",
"created_at": "2022-09-04T14:36:55.992684Z",
"updated_at": "2022-09-04T14:36:55.992705Z",
"structure_string": "K2 In1 Bi1 F6\n1.0\n5.853043 -0.000000 3.379256\n1.951014 5.518302 3.379256\n-0.000000 -0.000000 6.758511\nK In Bi F\n2 1 1 6\ndirect\n0.749999 0.750000 0.750001 K\n0.250000 0.250000 0.250000 K\n0.499999 0.500000 0.500001 In\n0.000000 0.000000 0.000000 Bi\n0.762723 0.237277 0.237278 F\n0.237277 0.237277 0.762723 F\n0.237276 0.762723 0.762724 F\n0.237276 0.762723 0.237278 F\n0.762723 0.237277 0.762724 F\n0.762722 0.762723 0.237278 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"K",
"In",
"Bi",
"F"
],
"chemical_system": "Bi-F-In-K",
"density": 3.925078282224553,
"density_atomic": 0.045810158656017765,
"volume": 218.29219311569375,
"volume_molar": 13.145863137518107,
"formula_full": "K2 In1 Bi1 F6",
"formula_reduced": "K2InBiF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-50378",
"created_at": "2022-09-04T14:37:06.019654Z",
"updated_at": "2022-09-04T14:37:06.019681Z",
"structure_string": "Sr4 Ca2 I12\n1.0\n7.560840 0.000000 0.000000\n0.000000 7.560840 0.000000\n0.000000 0.000000 14.456775\nSr Ca I\n4 2 12\ndirect\n0.000000 0.000000 0.333494 Sr\n0.000000 0.000000 0.666507 Sr\n0.500000 0.500000 0.166507 Sr\n0.500000 0.500000 0.833494 Sr\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Ca\n0.793104 0.206896 0.500000 I\n0.706896 0.706896 0.000000 I\n0.695821 0.695821 0.660215 I\n0.695821 0.695821 0.339786 I\n0.304179 0.304179 0.660215 I\n0.206896 0.793104 0.500000 I\n0.293104 0.293104 0.000000 I\n0.804179 0.195821 0.160215 I\n0.195821 0.804179 0.839786 I\n0.195821 0.804179 0.160215 I\n0.304179 0.304179 0.339786 I\n0.804179 0.195821 0.839786 I\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Sr",
"Ca",
"I"
],
"chemical_system": "Ca-I-Sr",
"density": 3.9250816229590497,
"density_atomic": 0.02178015608263528,
"volume": 826.4403584486204,
"volume_molar": 27.64966760179137,
"formula_full": "Sr4 Ca2 I12",
"formula_reduced": "Sr2CaI6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 4.77777777782018e-05,
"spacegroup": 136
},
{
"id": "jvasp-48189",
"created_at": "2022-09-04T14:35:57.120589Z",
"updated_at": "2022-09-04T14:35:57.120610Z",
"structure_string": "Li2 Ti2 V2 O8\n1.0\n2.944516 -2.916476 4.162650\n-2.929076 2.931981 4.162650\n-2.929130 -2.941720 4.202485\nLi Ti V O\n2 2 2 8\ndirect\n0.500000 0.499999 0.500000 Li\n0.500000 0.499999 0.000000 Li\n-0.000000 -0.000000 0.500000 Ti\n0.000000 0.000000 0.000000 Ti\n-0.000001 0.500000 0.500000 V\n0.500000 -0.000000 0.000000 V\n0.240634 0.759354 0.473055 O\n0.757491 0.775471 0.983528 O\n0.240645 0.759365 0.026946 O\n0.224527 0.242508 0.516473 O\n0.775472 0.757491 0.483528 O\n0.759354 0.240633 0.973055 O\n0.242508 0.224527 0.016473 O\n0.759366 0.240645 0.526946 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Ti",
"V",
"O"
],
"chemical_system": "Li-O-Ti-V",
"density": 3.925374072462174,
"density_atomic": 0.09748271779449305,
"volume": 143.61519987074962,
"volume_molar": 6.177649634979915,
"formula_full": "Li2 Ti2 V2 O8",
"formula_reduced": "LiTiVO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.6300209333333333,
"spacegroup": 74
},
{
"id": "jvasp-1807",
"created_at": "2022-09-04T14:36:12.923827Z",
"updated_at": "2022-09-04T14:36:12.923837Z",
"structure_string": "K1 Sm1 S2\n1.0\n3.973692 0.003512 6.567054\n1.834857 3.524704 6.567054\n0.005781 0.003512 7.675701\nK Sm S\n1 1 2\ndirect\n0.500000 0.499999 0.500000 K\n0.000000 0.000000 0.000000 Sm\n0.736189 0.736187 0.736189 S\n0.263811 0.263810 0.263811 S\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Sm",
"S"
],
"chemical_system": "K-S-Sm",
"density": 3.925396542405993,
"density_atomic": 0.03728766749152928,
"volume": 107.27407395243183,
"volume_molar": 16.15048933100485,
"formula_full": "K1 Sm1 S2",
"formula_reduced": "KSmS2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.58831421875,
"spacegroup": 166
}
]
}