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_molar&page=3484",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume_molar&page=3482",
"results": [
{
"id": "jvasp-34003",
"created_at": "2022-09-04T14:38:35.605417Z",
"updated_at": "2022-09-04T14:38:35.605434Z",
"structure_string": "Te8 Mo6 S4\n1.0\n-0.347862 -5.917145 0.000387\n-0.000449 -0.000162 14.113043\n-4.966667 3.260798 -0.000142\nTe Mo S\n8 6 4\ndirect\n0.642688 0.111519 0.669425 Te\n0.026719 0.888481 0.669382 Te\n0.977974 0.377276 0.336311 Te\n0.975055 0.122726 0.330359 Te\n0.355287 0.877281 0.330324 Te\n0.306533 0.388483 0.997241 Te\n0.358356 0.622717 0.336348 Te\n0.690723 0.611517 0.997278 Te\n0.326953 0.250000 0.333334 Mo\n0.707227 0.750948 0.683596 Mo\n0.626101 0.250949 0.983065 Mo\n0.006389 0.749999 0.333333 Mo\n0.976369 0.249053 0.683602 Mo\n0.356963 0.749052 0.983071 Mo\n0.689756 0.853178 0.000666 S\n0.310925 0.146823 0.000692 S\n0.022468 0.646820 0.666002 S\n0.643518 0.353179 0.665973 S\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Te",
"Mo",
"S"
],
"chemical_system": "Mo-S-Te",
"density": 6.6484081793123195,
"density_atomic": 0.041785684362070204,
"volume": 430.7695392525149,
"volume_molar": 14.411971113883277,
"formula_full": "Te8 Mo6 S4",
"formula_reduced": "Te4Mo3S2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 3.2878654185185185,
"spacegroup": 20
},
{
"id": "jvasp-110707",
"created_at": "2022-09-04T14:38:39.464343Z",
"updated_at": "2022-09-04T14:38:39.464370Z",
"structure_string": "Na2 Li1 Sc1 Cl6\n1.0\n6.035238 -0.000000 3.484446\n2.011746 5.690077 3.484446\n-0.000000 -0.000000 6.968892\nNa Li Sc Cl\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Sc\n0.750104 0.249897 0.249897 Cl\n0.249897 0.249897 0.750103 Cl\n0.249897 0.750104 0.750103 Cl\n0.249897 0.750104 0.249897 Cl\n0.750104 0.249897 0.750103 Cl\n0.750104 0.750104 0.249897 Cl\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Na",
"Li",
"Sc",
"Cl"
],
"chemical_system": "Cl-Li-Na-Sc",
"density": 2.1550954527592703,
"density_atomic": 0.04178531892259342,
"volume": 239.3185036717041,
"volume_molar": 14.41209715583579,
"formula_full": "Na2 Li1 Sc1 Cl6",
"formula_reduced": "Na2LiScCl6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.1016177655,
"spacegroup": 225
},
{
"id": "jvasp-114802",
"created_at": "2022-09-04T14:38:42.836647Z",
"updated_at": "2022-09-04T14:38:42.836682Z",
"structure_string": "Tl1 Pd1 Cl1\n1.0\n5.029059 0.000000 0.000000\n-2.514530 4.355293 -0.000000\n-0.000000 0.000000 3.277884\nTl Pd Cl\n1 1 1\ndirect\n0.666667 0.333333 0.000000 Tl\n0.333333 0.666666 0.000000 Pd\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Tl",
"Pd",
"Cl"
],
"chemical_system": "Cl-Pd-Tl",
"density": 8.0084615180703,
"density_atomic": 0.041785304021497285,
"volume": 71.7955767045895,
"volume_molar": 14.412102295347161,
"formula_full": "Tl1 Pd1 Cl1",
"formula_reduced": "TlPdCl",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3083307891666665,
"spacegroup": 187
},
{
"id": "jvasp-88178",
"created_at": "2022-09-04T14:35:42.449237Z",
"updated_at": "2022-09-04T14:35:42.449253Z",
"structure_string": "Sm6 Si2 Cu2 Se14\n1.0\n10.485218 0.000000 -0.000000\n-5.242609 9.080465 0.000000\n-0.000000 0.000000 6.032761\nSm Si Cu Se\n6 2 2 14\ndirect\n0.643941 0.773809 0.744643 Sm\n0.226190 0.870131 0.744643 Sm\n0.356059 0.226190 0.244643 Sm\n0.870131 0.643941 0.244643 Sm\n0.129869 0.356059 0.744643 Sm\n0.773810 0.129869 0.244643 Sm\n0.666667 0.333333 0.831897 Si\n0.000000 0.000000 0.710307 Si\n0.333333 0.666667 0.331893 Cu\n0.000000 0.000000 0.210318 Cu\n0.164234 0.904709 0.224172 Se\n0.580846 0.478633 0.983584 Se\n0.478633 0.897787 0.483585 Se\n0.095290 0.259525 0.224172 Se\n0.740475 0.835765 0.224172 Se\n0.419154 0.521366 0.483585 Se\n0.666667 0.333333 0.456088 Se\n0.333333 0.666667 0.956092 Se\n0.835766 0.095290 0.724171 Se\n0.904709 0.740475 0.724171 Se\n0.521367 0.102213 0.983584 Se\n0.897787 0.419154 0.983584 Se\n0.259525 0.164234 0.724171 Se\n0.102212 0.580845 0.483585 Se\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Sm",
"Si",
"Cu",
"Se"
],
"chemical_system": "Cu-Se-Si-Sm",
"density": 6.333775196648333,
"density_atomic": 0.04178395723284676,
"volume": 574.3831266688493,
"volume_molar": 14.412566829036335,
"formula_full": "Sm6 Si2 Cu2 Se14",
"formula_reduced": "Sm3CuSiSe7",
"formula_anonymous": "ABC3D7",
"energy_above_hull": 1.6149907701388886,
"spacegroup": 143
},
{
"id": "jvasp-91893",
"created_at": "2022-09-04T14:37:52.360875Z",
"updated_at": "2022-09-04T14:37:52.360886Z",
"structure_string": "Na1 Mg7\n1.0\n6.506155 0.000000 -0.000000\n-3.253078 5.634495 0.000000\n0.000000 0.000000 5.223055\nNa Mg\n1 7\ndirect\n0.166667 0.333333 0.250000 Na\n0.168765 0.834382 0.250000 Mg\n0.665618 0.331235 0.250000 Mg\n0.665617 0.834382 0.250000 Mg\n0.335585 0.164415 0.750001 Mg\n0.335585 0.671171 0.750001 Mg\n0.828829 0.164415 0.750001 Mg\n0.833333 0.666666 0.750001 Mg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Na",
"Mg"
],
"chemical_system": "Mg-Na",
"density": 1.6748775947706316,
"density_atomic": 0.04178168827361971,
"volume": 191.4714395361346,
"volume_molar": 14.413349505080395,
"formula_full": "Na1 Mg7",
"formula_reduced": "NaMg7",
"formula_anonymous": "AB7",
"energy_above_hull": 0.0,
"spacegroup": 187
},
{
"id": "jvasp-78376",
"created_at": "2022-09-04T14:37:51.945560Z",
"updated_at": "2022-09-04T14:37:51.945580Z",
"structure_string": "Sc2\n1.0\n-1.645389 -2.849785 0.000000\n-1.645389 2.849785 -0.000000\n0.000000 0.000000 -5.104463\nSc\n2\ndirect\n0.666688 0.333313 0.750000 Sc\n0.333313 0.666688 0.250000 Sc\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Sc"
],
"chemical_system": "Sc",
"density": 3.118926669329507,
"density_atomic": 0.04178007873427446,
"volume": 47.86970394958332,
"volume_molar": 14.413904766195936,
"formula_full": "Sc2",
"formula_reduced": "Sc",
"formula_anonymous": "A",
"energy_above_hull": 0.0,
"spacegroup": 194
},
{
"id": "jvasp-10101",
"created_at": "2022-09-04T14:37:50.485624Z",
"updated_at": "2022-09-04T14:37:50.485645Z",
"structure_string": "Na4 Zr2 Se6\n1.0\n6.584264 -0.000000 2.238597\n3.292132 6.031461 1.119299\n0.013231 -0.000000 7.236977\nNa Zr Se\n4 2 6\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.000000 0.500001 Na\n0.157470 0.685058 0.500001 Na\n0.842529 0.314942 0.500001 Na\n0.668667 0.662664 0.000001 Zr\n0.331332 0.337336 0.000000 Zr\n0.434796 0.641516 0.773290 Se\n0.282440 0.000000 0.224639 Se\n0.565203 0.358484 0.226712 Se\n0.923686 0.641516 0.226712 Se\n0.076313 0.358484 0.773289 Se\n0.717559 0.000000 0.775363 Se\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Na",
"Zr",
"Se"
],
"chemical_system": "Na-Se-Zr",
"density": 4.325444815928597,
"density_atomic": 0.041779605123081015,
"volume": 287.22147958671434,
"volume_molar": 14.414068161388837,
"formula_full": "Na4 Zr2 Se6",
"formula_reduced": "Na2ZrSe3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.0754671000000005,
"spacegroup": 12
},
{
"id": "jvasp-74611",
"created_at": "2022-09-04T14:35:50.633378Z",
"updated_at": "2022-09-04T14:35:50.633409Z",
"structure_string": "Be1 Tl1 In2\n1.0\n-2.300166 2.300166 4.523952\n2.300166 -2.300166 4.523952\n2.300166 2.300166 -4.523952\nBe Tl In\n1 1 2\ndirect\n0.750001 0.250000 0.500001 Be\n0.500000 0.500000 0.000000 Tl\n0.000000 0.000000 0.000000 In\n0.250000 0.750001 0.500001 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Tl",
"In"
],
"chemical_system": "Be-In-Tl",
"density": 7.683999838013755,
"density_atomic": 0.041779539847985235,
"volume": 95.74064277763688,
"volume_molar": 14.414090681495166,
"formula_full": "Be1 Tl1 In2",
"formula_reduced": "BeTlIn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2227185875,
"spacegroup": 119
},
{
"id": "jvasp-21729",
"created_at": "2022-09-04T14:38:36.104591Z",
"updated_at": "2022-09-04T14:38:36.104612Z",
"structure_string": "Er10 Ge6\n1.0\n4.187077 -7.252231 0.000000\n4.187077 7.252231 -0.000000\n-0.000000 -0.000000 6.306552\nEr Ge\n10 6\ndirect\n0.241050 0.000000 0.250000 Er\n0.758950 0.000000 0.750000 Er\n0.241050 0.241050 0.750000 Er\n0.000000 0.241050 0.250000 Er\n0.758950 0.758950 0.250000 Er\n0.000000 0.758950 0.750000 Er\n0.333333 0.666667 0.500000 Er\n0.666667 0.333333 0.000000 Er\n0.666667 0.333333 0.500000 Er\n0.333333 0.666667 0.000000 Er\n0.000000 0.606288 0.250000 Ge\n0.606288 0.606288 0.750000 Ge\n0.393712 0.000000 0.750000 Ge\n0.606288 0.000000 0.250000 Ge\n0.393712 0.393712 0.250000 Ge\n0.000000 0.393712 0.750000 Ge\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Er",
"Ge"
],
"chemical_system": "Er-Ge",
"density": 9.141210951597976,
"density_atomic": 0.0417749010108189,
"volume": 383.00509666932084,
"volume_molar": 14.415691274625358,
"formula_full": "Er10 Ge6",
"formula_reduced": "Er5Ge3",
"formula_anonymous": "A3B5",
"energy_above_hull": 1.24087973125,
"spacegroup": 193
},
{
"id": "jvasp-12427",
"created_at": "2022-09-04T14:37:07.175831Z",
"updated_at": "2022-09-04T14:37:07.175865Z",
"structure_string": "In4 Hg2 S8\n1.0\n6.752443 -0.000000 3.898525\n2.250815 6.366265 3.898525\n-0.000000 0.000000 7.797050\nIn Hg S\n4 2 8\ndirect\n0.500000 0.000000 0.500000 In\n-0.000000 0.500000 0.500000 In\n0.500000 0.500000 -0.000000 In\n0.500000 0.500000 0.500000 In\n0.125000 0.125000 0.125000 Hg\n0.874999 0.874999 0.875000 Hg\n0.739787 0.739787 0.739787 S\n0.260212 0.260212 0.719363 S\n0.260212 0.719362 0.260213 S\n0.719363 0.260212 0.260212 S\n0.739787 0.280637 0.739787 S\n0.280637 0.739787 0.739787 S\n0.260212 0.260212 0.260213 S\n0.739787 0.739787 0.280637 S\n",
"nsites": 14,
"nelements": 3,
"elements": [
"In",
"Hg",
"S"
],
"chemical_system": "Hg-In-S",
"density": 5.5336976363899195,
"density_atomic": 0.04176880758120166,
"volume": 335.1783498435516,
"volume_molar": 14.417794303302797,
"formula_full": "In4 Hg2 S8",
"formula_reduced": "In2HgS4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.7336477914285713,
"spacegroup": 227
},
{
"id": "jvasp-39320",
"created_at": "2022-09-04T14:37:40.745228Z",
"updated_at": "2022-09-04T14:37:40.745251Z",
"structure_string": "Li1 In3\n1.0\n-2.257296 2.257296 4.698650\n2.257296 -2.257296 4.698650\n2.257296 2.257296 -4.698650\nLi In\n1 3\ndirect\n0.000000 0.000000 0.000000 Li\n0.749999 0.249999 0.500000 In\n0.249999 0.749999 0.500000 In\n0.500001 0.500001 0.000000 In\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"In"
],
"chemical_system": "In-Li",
"density": 6.093047501614218,
"density_atomic": 0.04176859628027437,
"volume": 95.76572727413009,
"volume_molar": 14.417867240714562,
"formula_full": "Li1 In3",
"formula_reduced": "LiIn3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.00641,
"spacegroup": 139
},
{
"id": "jvasp-91685",
"created_at": "2022-09-04T14:35:56.559095Z",
"updated_at": "2022-09-04T14:35:56.559117Z",
"structure_string": "Eu4 Ga4\n1.0\n5.618782 -0.301398 1.260798\n-0.052407 5.581665 2.077778\n0.235365 -0.141191 6.114905\nEu Ga\n4 4\ndirect\n0.749492 0.831985 0.960088 Eu\n0.250506 0.168014 0.039914 Eu\n0.313009 0.723132 0.612554 Eu\n0.686989 0.276866 0.387449 Eu\n0.845829 0.769192 0.444369 Ga\n0.154169 0.230807 0.555633 Ga\n0.786180 0.374955 0.829703 Ga\n0.213818 0.625044 0.170299 Ga\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Eu",
"Ga"
],
"chemical_system": "Eu-Ga",
"density": 7.687825327021258,
"density_atomic": 0.041768047989836445,
"volume": 191.53396878749675,
"volume_molar": 14.4180565044969,
"formula_full": "Eu4 Ga4",
"formula_reduced": "EuGa",
"formula_anonymous": "AB",
"energy_above_hull": 0.0663561624999999,
"spacegroup": 2
}
]
}