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_atomic&page=4121",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=4119",
"results": [
{
"id": "jvasp-18422",
"created_at": "2022-09-04T14:36:21.944615Z",
"updated_at": "2022-09-04T14:36:21.944644Z",
"structure_string": "Li3 Cu2 O4\n1.0\n2.728708 0.016324 -4.479346\n-0.329241 3.408865 -3.972644\n-0.052147 -0.023644 10.496863\nLi Cu O\n3 2 4\ndirect\n0.285271 0.785273 0.750001 Li\n0.283616 0.783617 0.250001 Li\n0.710658 0.210658 0.750000 Li\n0.005266 0.505268 0.750000 Cu\n0.998887 0.498886 0.250000 Cu\n0.342769 0.363008 0.986283 O\n0.635042 0.608403 0.983677 O\n0.641049 0.667692 0.516324 O\n0.390442 0.370206 0.513717 O\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Li",
"Cu",
"O"
],
"chemical_system": "Cu-Li-O",
"density": 3.6422902942425597,
"density_atomic": 0.09315607643651917,
"volume": 96.61205521180375,
"volume_molar": 6.464571062204153,
"formula_full": "Li3 Cu2 O4",
"formula_reduced": "Li3(CuO2)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 1.273589433333333,
"spacegroup": 5
},
{
"id": "jvasp-59568",
"created_at": "2022-09-04T14:37:42.310064Z",
"updated_at": "2022-09-04T14:37:42.310091Z",
"structure_string": "Mg2 V4 O8\n1.0\n5.168212 0.000000 2.983869\n1.722737 4.872638 2.983869\n-0.000000 -0.000000 5.967738\nMg V O\n2 4 8\ndirect\n0.875000 0.874999 0.875000 Mg\n0.125000 0.125000 0.125000 Mg\n0.500001 0.500000 0.500000 V\n0.500001 0.500000 0.000000 V\n0.000000 0.500000 0.500000 V\n0.500001 0.000000 0.500000 V\n0.740600 0.740599 0.740601 O\n0.259400 0.259400 0.721800 O\n0.259401 0.721798 0.259401 O\n0.721799 0.259400 0.259401 O\n0.740599 0.278202 0.740599 O\n0.278202 0.740599 0.740599 O\n0.259400 0.259400 0.259401 O\n0.740600 0.740599 0.278201 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Mg",
"V",
"O"
],
"chemical_system": "Mg-O-V",
"density": 4.202836623787418,
"density_atomic": 0.0931566407968549,
"volume": 150.28450876121178,
"volume_molar": 6.464531898624789,
"formula_full": "Mg2 V4 O8",
"formula_reduced": "MgV2O4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.479655921428571,
"spacegroup": 227
},
{
"id": "jvasp-186",
"created_at": "2022-09-04T14:36:49.502180Z",
"updated_at": "2022-09-04T14:36:49.502209Z",
"structure_string": "Cr2 O4\n1.0\n2.861062 0.040286 -0.452485\n1.429212 2.520709 -0.012927\n-1.372182 0.842197 9.293010\nCr O\n2 4\ndirect\n-0.000720 -0.002252 0.497899 Cr\n0.000198 -0.001671 -0.002052 Cr\n0.470590 0.261637 0.604769 O\n0.195683 0.401094 0.891201 O\n0.527987 0.733873 0.391032 O\n0.804696 0.595563 0.104693 O\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cr",
"O"
],
"chemical_system": "Cr-O",
"density": 4.3310826237448214,
"density_atomic": 0.0931570460077753,
"volume": 64.40736645405451,
"volume_molar": 6.464503779453639,
"formula_full": "Cr2 O4",
"formula_reduced": "CrO2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.2120048,
"spacegroup": 166
},
{
"id": "jvasp-11518",
"created_at": "2022-09-04T14:37:11.210667Z",
"updated_at": "2022-09-04T14:37:11.210687Z",
"structure_string": "V4 Zn2 O8\n1.0\n5.967440 -0.004955 -0.004514\n-2.979546 5.170890 0.006997\n-2.981497 -1.724658 4.873306\nV Zn O\n4 2 8\ndirect\n-0.000000 -0.000000 0.500000 V\n0.500000 -0.000000 0.500001 V\n0.500000 -0.000000 0.000000 V\n-0.000000 0.500000 0.500001 V\n0.749999 0.624997 0.875003 Zn\n0.250000 0.375002 0.124999 Zn\n0.480042 0.220053 0.740031 O\n0.980056 0.240036 0.720053 O\n0.519954 0.239999 0.259987 O\n0.980049 0.240031 0.260001 O\n0.480046 0.760000 0.740015 O\n0.019951 0.759968 0.740001 O\n0.519958 0.779947 0.259972 O\n0.019944 0.759963 0.279949 O\n",
"nsites": 14,
"nelements": 3,
"elements": [
"V",
"Zn",
"O"
],
"chemical_system": "O-V-Zn",
"density": 5.111233650333753,
"density_atomic": 0.09315766016775902,
"volume": 150.28286428393216,
"volume_molar": 6.46446116095583,
"formula_full": "V4 Zn2 O8",
"formula_reduced": "V2ZnO4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.4163704,
"spacegroup": 227
},
{
"id": "jvasp-50867",
"created_at": "2022-09-04T14:37:14.397765Z",
"updated_at": "2022-09-04T14:37:14.397775Z",
"structure_string": "Lu2 H2 O4\n1.0\n3.377474 0.000000 0.000000\n0.000000 4.755962 0.000000\n0.000000 0.000000 5.345836\nLu H O\n2 2 4\ndirect\n0.000000 0.722205 0.984220 Lu\n0.499999 0.277794 0.484220 Lu\n0.499999 0.188681 0.962395 H\n0.000000 0.811319 0.462395 H\n0.499999 0.015218 0.850353 O\n0.000000 0.516782 0.625810 O\n0.000000 0.984782 0.350353 O\n0.499999 0.483217 0.125810 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Lu",
"H",
"O"
],
"chemical_system": "H-Lu-O",
"density": 8.043435307966641,
"density_atomic": 0.09316310729473527,
"volume": 85.87090139330385,
"volume_molar": 6.46408319223195,
"formula_full": "Lu2 H2 O4",
"formula_reduced": "LuHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4629831875,
"spacegroup": 31
},
{
"id": "jvasp-12650",
"created_at": "2022-09-04T14:37:20.102390Z",
"updated_at": "2022-09-04T14:37:20.102405Z",
"structure_string": "Mn2 Ge2 O6\n1.0\n4.528363 -0.009546 3.320278\n1.677427 4.206234 3.320278\n-0.014116 -0.009546 5.615169\nMn Ge O\n2 2 6\ndirect\n0.366157 0.366156 0.366156 Mn\n0.633843 0.633843 0.633845 Mn\n0.156339 0.156338 0.156340 Ge\n0.843660 0.843659 0.843664 Ge\n0.044428 0.790778 0.439108 O\n0.790781 0.439105 0.044425 O\n0.439105 0.044426 0.790782 O\n0.955573 0.209219 0.560893 O\n0.560893 0.955573 0.209220 O\n0.209220 0.560891 0.955576 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Mn",
"Ge",
"O"
],
"chemical_system": "Ge-Mn-O",
"density": 5.4326998551685675,
"density_atomic": 0.09316887727597443,
"volume": 107.33197922283766,
"volume_molar": 6.463682869293238,
"formula_full": "Mn2 Ge2 O6",
"formula_reduced": "MnGeO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.283930738275862,
"spacegroup": 148
},
{
"id": "jvasp-115094",
"created_at": "2022-09-04T14:38:44.075818Z",
"updated_at": "2022-09-04T14:38:44.075830Z",
"structure_string": "Al1 Ga1 O3\n1.0\n3.771947 0.000000 -0.000000\n0.000000 3.771947 -0.000000\n0.000000 -0.000000 3.771947\nAl Ga O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Ga\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Al",
"Ga",
"O"
],
"chemical_system": "Al-Ga-O",
"density": 4.4774330699974705,
"density_atomic": 0.09316939147522739,
"volume": 53.66569343033049,
"volume_molar": 6.46364719640915,
"formula_full": "Al1 Ga1 O3",
"formula_reduced": "AlGaO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.566535125,
"spacegroup": 221
},
{
"id": "jvasp-86113",
"created_at": "2022-09-04T14:36:07.073565Z",
"updated_at": "2022-09-04T14:36:07.073572Z",
"structure_string": "K1 Na1 B2 H8\n1.0\n4.309898 -0.002940 6.462356\n1.955092 3.840943 6.462356\n-0.004800 -0.002940 7.767705\nK Na B H\n1 1 2 8\ndirect\n0.352961 0.352961 0.352962 K\n0.857204 0.857203 0.857206 Na\n0.592957 0.592956 0.592958 B\n0.102728 0.102727 0.102728 B\n0.375320 0.859397 0.126690 H\n0.537188 0.537187 0.537189 H\n0.859398 0.126688 0.375320 H\n0.758957 0.316155 0.761166 H\n0.126688 0.375319 0.859398 H\n0.046660 0.046660 0.046660 H\n0.316155 0.761164 0.758959 H\n0.761165 0.758957 0.316156 H\n",
"nsites": 12,
"nelements": 4,
"elements": [
"K",
"Na",
"B",
"H"
],
"chemical_system": "B-H-K-Na",
"density": 1.183219172153103,
"density_atomic": 0.0931707581189953,
"volume": 128.79577500779706,
"volume_molar": 6.463552386585368,
"formula_full": "K1 Na1 B2 H8",
"formula_reduced": "KNa(BH4)2",
"formula_anonymous": "ABC2D8",
"energy_above_hull": 2.803450180555556,
"spacegroup": 146
},
{
"id": "jvasp-103769",
"created_at": "2022-09-04T14:37:03.924252Z",
"updated_at": "2022-09-04T14:37:03.924283Z",
"structure_string": "H8 C14 S2 O1\n1.0\n4.362204 0.142023 0.784559\n1.943760 5.680107 0.893188\n0.387863 -0.088840 11.011066\nH C S O\n8 14 2 1\ndirect\n0.679371 0.804566 0.061186 H\n0.091874 0.969523 0.773025 H\n0.727115 0.025690 0.630224 H\n0.290844 0.018322 0.970332 H\n0.413084 0.183276 0.440558 H\n0.654244 0.304218 0.253909 H\n0.566139 0.190251 0.062747 H\n0.764758 0.916080 0.255678 H\n0.939901 0.758204 0.211832 C\n0.895397 0.695068 0.102319 C\n0.206488 0.612432 0.268814 C\n0.111861 0.485125 0.048323 C\n0.433435 0.408021 0.214723 C\n0.383444 0.345583 0.106334 C\n0.692919 0.385672 0.646824 C\n0.054326 0.401616 0.941218 C\n0.848097 0.354279 0.753455 C\n0.482565 0.294678 0.489557 C\n0.647847 0.210811 0.593386 C\n0.036951 0.140465 0.808439 C\n0.150831 0.167967 0.913244 C\n0.406518 0.536148 0.462635 C\n0.533096 0.661974 0.565100 S\n0.816202 0.589835 0.834024 S\n0.238828 0.692577 0.375876 O\n",
"nsites": 25,
"nelements": 4,
"elements": [
"H",
"C",
"S",
"O"
],
"chemical_system": "C-H-O-S",
"density": 1.5864067894952372,
"density_atomic": 0.09317179938113236,
"volume": 268.3215325458509,
"volume_molar": 6.463480151720142,
"formula_full": "H8 C14 S2 O1",
"formula_reduced": "H8C14S2O",
"formula_anonymous": "AB2C8D14",
"energy_above_hull": 5.68658334,
"spacegroup": 1
},
{
"id": "jvasp-10073",
"created_at": "2022-09-04T14:38:08.124888Z",
"updated_at": "2022-09-04T14:38:08.124900Z",
"structure_string": "In2 B2 O6\n1.0\n4.440651 -0.010564 3.884079\n1.756532 4.078491 3.884079\n-0.016094 -0.010564 5.899593\nIn B O\n2 2 6\ndirect\n0.500000 0.500001 0.499999 In\n0.000000 0.000000 0.000000 In\n0.750000 0.750001 0.749999 B\n0.250000 0.250000 0.250000 B\n0.967020 0.532980 0.250000 O\n0.250000 0.967021 0.532979 O\n0.532979 0.250001 0.967020 O\n0.032979 0.467021 0.749999 O\n0.750000 0.032980 0.467020 O\n0.467020 0.750000 0.032979 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"In",
"B",
"O"
],
"chemical_system": "B-In-O",
"density": 5.372808805705027,
"density_atomic": 0.09317610062163256,
"volume": 107.32365846267572,
"volume_molar": 6.463181781403985,
"formula_full": "In2 B2 O6",
"formula_reduced": "InBO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.9472606106666663,
"spacegroup": 167
},
{
"id": "jvasp-47067",
"created_at": "2022-09-04T14:38:06.576860Z",
"updated_at": "2022-09-04T14:38:06.576878Z",
"structure_string": "Li4 Mn4 P4 O16\n1.0\n4.385341 0.000000 0.000000\n-0.000000 4.807796 0.000000\n0.000000 0.000000 14.252796\nLi Mn P O\n4 4 4 16\ndirect\n0.000000 0.250000 0.248329 Li\n0.000000 0.750001 0.751671 Li\n0.500000 0.750001 0.251671 Li\n0.500000 0.250000 0.748329 Li\n0.000000 0.750001 0.073779 Mn\n0.000000 0.250000 0.926221 Mn\n0.500000 0.750001 0.573779 Mn\n0.500000 0.250000 0.426221 Mn\n0.500000 0.250000 0.114544 P\n0.500000 0.750001 0.885456 P\n0.000000 0.250000 0.614544 P\n0.000000 0.750001 0.385456 P\n0.265652 0.588817 0.945867 O\n0.265652 0.088816 0.054133 O\n0.234348 0.588817 0.445867 O\n0.234348 0.088816 0.554133 O\n0.315600 0.961543 0.824572 O\n0.315600 0.461543 0.175429 O\n0.684399 0.538458 0.824572 O\n0.815600 0.038458 0.675429 O\n0.765652 0.411184 0.554133 O\n0.765652 0.911185 0.445867 O\n0.734347 0.911185 0.945867 O\n0.734347 0.411184 0.054133 O\n0.184399 0.961543 0.324571 O\n0.815600 0.538458 0.324571 O\n0.684399 0.038458 0.175429 O\n0.184399 0.461543 0.675429 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Mn",
"P",
"O"
],
"chemical_system": "Li-Mn-O-P",
"density": 3.466931560371167,
"density_atomic": 0.0931769651598016,
"volume": 300.50345546218495,
"volume_molar": 6.463121813070244,
"formula_full": "Li4 Mn4 P4 O16",
"formula_reduced": "LiMnPO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.5494038201970444,
"spacegroup": 60
},
{
"id": "jvasp-117290",
"created_at": "2022-09-04T14:38:26.097650Z",
"updated_at": "2022-09-04T14:38:26.097677Z",
"structure_string": "Fe6 O6 F6\n1.0\n13.935017 0.096708 0.000000\n-0.070480 4.621538 0.000000\n-0.000000 -0.000000 2.999321\nFe O F\n6 6 6\ndirect\n0.004250 0.002082 -0.000000 Fe\n0.169174 0.424309 0.500000 Fe\n0.338033 0.001868 -0.000000 Fe\n0.505962 0.578785 0.500000 Fe\n0.673477 0.994101 -0.000000 Fe\n0.811021 0.497881 0.500000 Fe\n0.760268 0.299303 -0.000000 O\n0.733926 0.813909 0.500000 O\n0.571764 0.738355 -0.000000 O\n0.398772 0.805280 0.500000 O\n0.273849 0.194358 0.500000 O\n0.099614 0.270162 -0.000000 O\n0.063865 0.763694 0.500000 F\n0.227173 0.691852 -0.000000 F\n0.442021 0.317230 -0.000000 F\n0.599741 0.226608 0.500000 F\n0.900148 0.689013 -0.000000 F\n0.926944 0.191213 0.500000 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-O",
"density": 4.685197833853019,
"density_atomic": 0.09317718033714457,
"volume": 193.18034667791292,
"volume_molar": 6.4631068875555,
"formula_full": "Fe6 O6 F6",
"formula_reduced": "FeOF",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0752530941666667,
"spacegroup": 6
}
]
}