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=nelements&page=4572",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=4570",
"results": [
{
"id": "jvasp-117189",
"created_at": "2022-09-04T14:38:43.618895Z",
"updated_at": "2022-09-04T14:38:43.618921Z",
"structure_string": "Ba2 Nd1 Co1 Cu2 O7\n1.0\n3.920597 -0.000000 0.000000\n0.000000 3.929439 0.000000\n0.000000 -0.000000 11.780760\nBa Nd Co Cu O\n2 1 1 2 7\ndirect\n0.500000 0.500000 0.184615 Ba\n0.500000 0.500000 0.815385 Ba\n0.500000 0.500000 0.500000 Nd\n0.000000 0.000000 0.000000 Co\n0.000000 0.000000 0.357588 Cu\n0.000000 0.000000 0.642412 Cu\n0.500000 0.000000 0.369511 O\n0.500000 0.000000 0.630490 O\n0.000000 0.000000 0.150955 O\n0.000000 0.000000 0.849045 O\n-0.000000 0.500000 0.370529 O\n-0.000000 0.500000 0.629471 O\n-0.000000 0.500000 -0.000000 O\n",
"nsites": 13,
"nelements": 5,
"elements": [
"Ba",
"Nd",
"Co",
"Cu",
"O"
],
"chemical_system": "Ba-Co-Cu-Nd-O",
"density": 6.5593666916229285,
"density_atomic": 0.0716287363018609,
"volume": 181.4914051424116,
"volume_molar": 8.40743683459839,
"formula_full": "Ba2 Nd1 Co1 Cu2 O7",
"formula_reduced": "Ba2NdCoCu2O7",
"formula_anonymous": "ABC2D2E7",
"energy_above_hull": 1.772387672307692,
"spacegroup": 47
},
{
"id": "jvasp-112073",
"created_at": "2022-09-04T14:38:43.409034Z",
"updated_at": "2022-09-04T14:38:43.409051Z",
"structure_string": "H5 C8 S1 N1 O1\n1.0\n4.259888 -0.019871 0.251570\n1.458754 5.433413 0.863794\n-0.155274 0.040506 7.559378\nH C S N O\n5 8 1 1 1\ndirect\n0.728304 0.059924 0.578035 H\n0.202150 0.426454 0.954413 H\n0.191958 0.919745 0.310747 H\n0.241813 0.805838 0.643439 H\n0.636796 0.165184 0.247395 H\n0.327397 0.667230 0.555317 C\n0.298880 0.730514 0.370711 C\n0.499586 0.428169 0.628302 C\n0.422102 0.551879 0.259058 C\n0.630017 0.395087 0.811475 C\n0.485957 0.618976 0.067358 C\n0.603636 0.245829 0.518465 C\n0.552809 0.304917 0.334757 C\n0.666808 0.841379 0.000781 S\n0.418688 0.476943 0.948467 N\n0.924047 0.309246 0.840390 O\n",
"nsites": 16,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 1.5461765651102315,
"density_atomic": 0.09128919920414816,
"volume": 175.2671744246494,
"volume_molar": 6.596772468704442,
"formula_full": "H5 C8 S1 N1 O1",
"formula_reduced": "H5C8SNO",
"formula_anonymous": "ABCD5E8",
"energy_above_hull": 5.502680421875,
"spacegroup": 1
},
{
"id": "jvasp-46701",
"created_at": "2022-09-04T14:38:33.313569Z",
"updated_at": "2022-09-04T14:38:33.313596Z",
"structure_string": "Li4 V3 Ni3 Sb2 O16\n1.0\n5.840201 -0.000217 0.001083\n-2.919994 5.087607 0.009213\n-0.001800 -0.074620 9.690303\nLi V Ni Sb O\n4 3 3 2 16\ndirect\n0.339464 0.678955 0.104712 Li\n-0.000520 -0.001023 0.011852 Li\n0.997332 0.994686 0.508706 Li\n0.667668 0.335331 0.595023 Li\n0.173972 0.819939 0.784066 V\n0.645934 0.819928 0.784076 V\n0.825137 0.650301 0.278239 V\n0.343976 0.176164 0.287360 Ni\n0.832167 0.176166 0.287359 Ni\n0.172346 0.344713 0.788642 Ni\n0.329556 0.659129 0.503939 Sb\n0.661432 0.322884 0.011321 Sb\n0.831735 0.663498 0.898008 O\n0.322586 0.151434 0.903599 O\n0.682871 0.365761 0.395009 O\n0.971465 0.499343 0.150989 O\n0.527851 0.499339 0.150986 O\n0.157965 0.315946 0.409557 O\n0.493609 0.529494 0.656979 O\n0.483392 0.966797 0.655037 O\n0.669475 0.827720 0.402578 O\n0.991225 0.982473 0.200352 O\n0.991983 0.983991 0.700263 O\n0.343740 0.687518 0.902062 O\n0.520420 0.040867 0.158267 O\n0.158224 0.827720 0.402581 O\n0.035874 0.529494 0.656980 O\n0.828825 0.151430 0.903600 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Li",
"V",
"Ni",
"Sb",
"O"
],
"chemical_system": "Li-Ni-O-Sb-V",
"density": 4.937849474931305,
"density_atomic": 0.09724833142973603,
"volume": 287.92267783258154,
"volume_molar": 6.192538906799778,
"formula_full": "Li4 V3 Ni3 Sb2 O16",
"formula_reduced": "Li4V3Ni3(SbO8)2",
"formula_anonymous": "A2B3C3D4E16",
"energy_above_hull": 2.717041714285714,
"spacegroup": 8
},
{
"id": "jvasp-113226",
"created_at": "2022-09-04T14:38:48.294703Z",
"updated_at": "2022-09-04T14:38:48.294735Z",
"structure_string": "Li4 Cr2 P4 H3 O16\n1.0\n4.867442 0.018344 0.150473\n1.838870 7.350657 0.069131\n-0.009702 -0.021248 8.196049\nLi Cr P H O\n4 2 4 3 16\ndirect\n0.119677 0.324919 0.346412 Li\n0.391840 0.151069 0.875489 Li\n0.598380 0.839511 0.119761 Li\n0.887819 0.680277 0.642184 Li\n0.006501 0.500903 0.994262 Cr\n0.494854 0.002428 0.496650 Cr\n0.631392 0.240823 0.152670 P\n0.879208 0.251358 0.668288 P\n0.112660 0.746625 0.328884 P\n0.374429 0.766148 0.842751 P\n0.965726 0.012137 0.009974 H\n0.444207 0.513648 0.428223 H\n0.536409 0.498645 0.654454 H\n0.655219 0.143477 0.691710 O\n0.855348 0.350456 0.173579 O\n0.716721 0.451354 0.592483 O\n0.626739 0.657399 0.941471 O\n0.480616 0.811938 0.671303 O\n0.757238 0.053406 0.060199 O\n0.351639 0.842970 0.308612 O\n0.991241 0.700329 0.169917 O\n0.517925 0.192578 0.319720 O\n0.389829 0.340907 0.044721 O\n0.236962 0.549063 0.416437 O\n0.166142 0.642645 0.814584 O\n0.006710 0.296061 0.825979 O\n0.103242 0.175454 0.535206 O\n0.246780 0.941602 0.940185 O\n0.883430 0.839961 0.453786 O\n",
"nsites": 29,
"nelements": 5,
"elements": [
"Li",
"Cr",
"P",
"H",
"O"
],
"chemical_system": "Cr-H-Li-O-P",
"density": 2.9169871108214407,
"density_atomic": 0.09898249137899189,
"volume": 292.98110803215224,
"volume_molar": 6.084046457208231,
"formula_full": "Li4 Cr2 P4 H3 O16",
"formula_reduced": "Li4Cr2P4H3O16",
"formula_anonymous": "A2B3C4D4E16",
"energy_above_hull": 3.0526969931034484,
"spacegroup": 1
},
{
"id": "jvasp-112038",
"created_at": "2022-09-04T14:38:43.117325Z",
"updated_at": "2022-09-04T14:38:43.117343Z",
"structure_string": "H6 C10 S2 N2 O4\n1.0\n4.964669 0.103699 -0.680646\n-1.214038 6.283037 -0.758167\n-0.016351 -0.278800 8.396299\nH C S N O\n6 10 2 2 4\ndirect\n0.370140 0.758342 0.244443 H\n0.370200 0.758320 0.744419 H\n0.320459 0.357567 0.097361 H\n0.320444 0.357536 0.597334 H\n0.229980 0.149344 0.802274 H\n0.229915 0.149331 0.302253 H\n0.836990 0.208151 0.328840 C\n0.837039 0.208145 0.828842 C\n0.987291 0.767891 0.591993 C\n0.987239 0.767882 0.091993 C\n0.939592 0.396746 0.453939 C\n0.172657 0.460494 0.570725 C\n0.172658 0.460509 0.070740 C\n0.200878 0.674281 0.651276 C\n0.200839 0.674293 0.151290 C\n0.939612 0.396742 0.953941 C\n0.746585 0.598344 0.944772 S\n0.746599 0.598369 0.444784 S\n0.025587 0.081546 0.786719 N\n0.025520 0.081542 0.286708 N\n0.593859 0.166798 0.758952 O\n0.941667 0.972320 0.121246 O\n0.941768 0.972342 0.621248 O\n0.593804 0.166816 0.258961 O\n",
"nsites": 24,
"nelements": 5,
"elements": [
"H",
"C",
"S",
"N",
"O"
],
"chemical_system": "C-H-N-O-S",
"density": 1.791797417799236,
"density_atomic": 0.09173749563078322,
"volume": 261.61603644155525,
"volume_molar": 6.564535818851397,
"formula_full": "H6 C10 S2 N2 O4",
"formula_reduced": "H3C5SNO2",
"formula_anonymous": "ABC2D3E5",
"energy_above_hull": 5.052380854166666,
"spacegroup": 1
},
{
"id": "jvasp-116894",
"created_at": "2022-09-04T14:38:47.125922Z",
"updated_at": "2022-09-04T14:38:47.125952Z",
"structure_string": "Li4 Nb3 Co3 Sn2 O16\n1.0\n5.858245 -0.060429 0.030493\n2.838717 5.124877 0.030493\n-0.029987 -0.017462 10.043654\nLi Nb Co Sn O\n4 3 3 2 16\ndirect\n0.337037 0.337038 0.093874 Li\n0.987732 0.987733 0.006308 Li\n0.978635 0.978636 0.512573 Li\n0.668940 0.668941 0.614684 Li\n0.178977 0.178978 0.785637 Nb\n0.839991 0.354283 0.286943 Nb\n0.354283 0.839992 0.286943 Nb\n0.166997 0.655162 0.785195 Co\n0.810074 0.810075 0.283713 Co\n0.655160 0.166997 0.785195 Co\n0.351500 0.351501 0.514940 Sn\n0.667385 0.667386 0.997201 Sn\n0.839677 0.839679 0.888791 O\n0.839226 0.313189 0.896091 O\n0.659413 0.659414 0.419642 O\n0.507772 0.973891 0.146014 O\n0.973890 0.507773 0.146014 O\n0.172669 0.172670 0.406448 O\n0.032659 0.487430 0.658176 O\n0.484834 0.484835 0.676629 O\n0.166957 0.680617 0.400228 O\n-0.000899 -0.000899 0.190690 O\n-0.004793 -0.004793 0.693634 O\n0.338713 0.338714 0.901364 O\n0.515288 0.515288 0.160750 O\n0.680616 0.166958 0.400228 O\n0.487428 0.032660 0.658176 O\n0.313188 0.839228 0.896091 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Li",
"Nb",
"Co",
"Sn",
"O"
],
"chemical_system": "Co-Li-Nb-O-Sn",
"density": 5.34787262253355,
"density_atomic": 0.09232766616394018,
"volume": 303.26771122192383,
"volume_molar": 6.5225744462194895,
"formula_full": "Li4 Nb3 Co3 Sn2 O16",
"formula_reduced": "Li4Nb3Co3(SnO8)2",
"formula_anonymous": "A2B3C3D4E16",
"energy_above_hull": 3.0682310821428573,
"spacegroup": 8
},
{
"id": "jvasp-113170",
"created_at": "2022-09-04T14:38:47.048901Z",
"updated_at": "2022-09-04T14:38:47.048926Z",
"structure_string": "V2 Co1 P2 H8 O14\n1.0\n5.775752 -0.000031 -2.463517\n1.050763 5.679295 2.463476\n-0.024348 0.029176 7.945761\nV Co P H O\n2 1 2 8 14\ndirect\n0.277333 0.722663 0.554652 V\n0.722664 0.277338 0.445344 V\n0.000000 -0.000000 0.000000 Co\n0.250002 0.249998 0.500004 P\n0.749995 0.750003 0.499993 P\n0.708438 0.123195 0.122197 H\n0.413758 0.754606 0.122196 H\n0.245370 0.291585 0.122180 H\n0.876827 0.586226 0.122215 H\n0.291560 0.876801 0.877804 H\n0.586243 0.245396 0.877805 H\n0.123175 0.413772 0.877786 H\n0.754626 0.708416 0.877822 H\n0.343043 0.378088 0.638939 O\n0.982970 0.343034 0.361087 O\n0.704092 0.017038 0.361075 O\n0.378090 0.295910 0.361071 O\n0.621907 0.704091 0.638927 O\n0.295905 0.982963 0.638922 O\n0.846741 0.153254 0.693516 O\n0.262144 0.799994 -0.000002 O\n0.737857 0.200004 0.000005 O\n0.199978 0.262160 -0.000011 O\n0.153256 0.846747 0.306481 O\n0.017026 0.656966 0.638910 O\n0.800022 0.737838 0.000014 O\n0.656956 0.621913 0.361058 O\n",
"nsites": 27,
"nelements": 5,
"elements": [
"V",
"Co",
"P",
"H",
"O"
],
"chemical_system": "Co-H-O-P-V",
"density": 2.9069398173001644,
"density_atomic": 0.10392314041775198,
"volume": 259.8073912264867,
"volume_molar": 5.794802520201081,
"formula_full": "V2 Co1 P2 H8 O14",
"formula_reduced": "V2CoP2(H4O7)2",
"formula_anonymous": "AB2C2D8E14",
"energy_above_hull": 3.368735159259259,
"spacegroup": 87
},
{
"id": "jvasp-112942",
"created_at": "2022-09-04T14:38:43.312168Z",
"updated_at": "2022-09-04T14:38:43.312197Z",
"structure_string": "Sr4 Fe2 Cu2 Pb4 O12\n1.0\n5.332507 -0.000000 0.000000\n0.000000 5.413865 0.000000\n-0.000000 -0.000000 12.595249\nSr Fe Cu Pb O\n4 2 2 4 12\ndirect\n0.000000 -0.000363 0.645676 Sr\n-0.000000 0.000363 0.354324 Sr\n0.500000 0.500362 0.645676 Sr\n0.500000 0.499637 0.354324 Sr\n0.500000 0.000000 0.500000 Fe\n-0.000000 0.500000 0.500000 Fe\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 -0.000000 Cu\n0.500000 0.994414 0.855470 Pb\n0.500000 0.005585 0.144530 Pb\n-0.000000 0.505585 0.855470 Pb\n-0.000000 0.494414 0.144530 Pb\n0.500000 0.555347 0.854066 O\n0.250000 0.250000 0.498876 O\n0.250000 0.749999 0.501124 O\n0.750000 0.250000 0.498876 O\n0.750000 0.749999 0.501124 O\n-0.000000 0.493235 0.680998 O\n-0.000000 0.506764 0.319003 O\n0.500000 0.006764 0.680998 O\n0.500000 0.993235 0.319003 O\n-0.000000 0.944651 0.854066 O\n-0.000000 0.055348 0.145934 O\n0.500000 0.444652 0.145934 O\n",
"nsites": 24,
"nelements": 5,
"elements": [
"Sr",
"Fe",
"Cu",
"Pb",
"O"
],
"chemical_system": "Cu-Fe-O-Pb-Sr",
"density": 7.352654204372155,
"density_atomic": 0.06600329667333565,
"volume": 363.61820105412465,
"volume_molar": 9.123999956857997,
"formula_full": "Sr4 Fe2 Cu2 Pb4 O12",
"formula_reduced": "Sr2FeCu(PbO3)2",
"formula_anonymous": "ABC2D2E6",
"energy_above_hull": 1.5559309341666667,
"spacegroup": 53
},
{
"id": "jvasp-116896",
"created_at": "2022-09-04T14:38:47.671363Z",
"updated_at": "2022-09-04T14:38:47.671395Z",
"structure_string": "Li4 Co3 Sn3 Sb2 O16\n1.0\n6.150753 0.019708 0.050263\n3.101867 5.311363 0.050263\n-0.001884 -0.001086 9.755933\nLi Co Sn Sb O\n4 3 3 2 16\ndirect\n0.661928 0.661928 0.104210 Li\n0.910687 0.910687 0.040577 Li\n0.991008 0.991007 0.501822 Li\n0.334692 0.334691 0.592165 Li\n0.833448 0.833447 0.778538 Co\n0.190208 0.652090 0.288461 Co\n0.652090 0.190207 0.288461 Co\n0.837429 0.341046 0.790654 Sn\n0.170639 0.170639 0.282637 Sn\n0.341047 0.837427 0.790654 Sn\n0.676534 0.676533 0.505818 Sb\n0.344693 0.344693 0.014688 Sb\n0.180816 0.180814 0.898699 O\n0.165442 0.675272 0.905622 O\n0.331728 0.331727 0.393889 O\n0.489879 0.038194 0.144910 O\n0.038194 0.489879 0.144910 O\n0.836969 0.836968 0.404089 O\n0.965343 0.518309 0.651914 O\n0.520208 0.520207 0.655644 O\n0.833677 0.338732 0.408001 O\n-0.001924 -0.001924 0.200454 O\n0.004656 0.004655 0.689176 O\n0.670690 0.670688 0.900836 O\n0.486989 0.486989 0.149803 O\n0.338733 0.833676 0.408001 O\n0.518310 0.965342 0.651914 O\n0.675274 0.165441 0.905622 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Li",
"Co",
"Sn",
"Sb",
"O"
],
"chemical_system": "Co-Li-O-Sb-Sn",
"density": 5.534112361504955,
"density_atomic": 0.08801718489639222,
"volume": 318.11969484095266,
"volume_molar": 6.842005645930224,
"formula_full": "Li4 Co3 Sn3 Sb2 O16",
"formula_reduced": "Li4Co3Sn3(SbO8)2",
"formula_anonymous": "A2B3C3D4E16",
"energy_above_hull": 2.4935937857142854,
"spacegroup": 8
},
{
"id": "jvasp-112230",
"created_at": "2022-09-04T14:38:43.913680Z",
"updated_at": "2022-09-04T14:38:43.913693Z",
"structure_string": "H8 Pb1 C6 S1 O4\n1.0\n4.254708 -0.330059 -0.265821\n-1.608486 4.735076 0.003234\n0.011922 0.287163 10.195558\nH Pb C S O\n8 1 6 1 4\ndirect\n0.269426 0.283884 0.316869 H\n0.639459 0.300768 0.409554 H\n0.251661 0.705649 0.432512 H\n0.214924 0.406036 0.536152 H\n0.077505 0.713075 0.740231 H\n0.844722 0.410763 0.637720 H\n0.316773 0.308886 0.761744 H\n0.666338 0.285962 0.855659 H\n0.283627 0.972124 0.086862 Pb\n0.553287 0.645184 0.904686 C\n0.574961 0.439792 0.802584 C\n0.823829 0.582390 0.696470 C\n0.717897 0.640313 0.267101 C\n0.504862 0.434824 0.369370 C\n0.389756 0.577960 0.475869 C\n0.722292 0.831795 0.584868 S\n0.793240 0.895201 0.922121 O\n0.712747 0.892200 0.250385 O\n0.289029 0.555516 0.973184 O\n0.897577 0.549565 0.198184 O\n",
"nsites": 20,
"nelements": 5,
"elements": [
"H",
"Pb",
"C",
"S",
"O"
],
"chemical_system": "C-H-O-Pb-S",
"density": 3.181192873606591,
"density_atomic": 0.09993779329738026,
"volume": 200.1244908468904,
"volume_molar": 6.025889267016529,
"formula_full": "H8 Pb1 C6 S1 O4",
"formula_reduced": "H8PbC6SO4",
"formula_anonymous": "ABC4D6E8",
"energy_above_hull": 4.308667241,
"spacegroup": 1
},
{
"id": "jvasp-7136",
"created_at": "2022-09-04T14:38:33.442199Z",
"updated_at": "2022-09-04T14:38:33.442220Z",
"structure_string": "H5 Pb1 C1 I3 N2\n1.0\n6.485829 0.000000 -0.000000\n0.000001 6.309774 -0.000000\n0.000000 -0.000000 6.406172\nH Pb C I N\n5 1 1 3 2\ndirect\n0.500000 0.702377 0.500000 H\n0.809213 0.525516 0.500000 H\n0.697814 0.272378 0.500000 H\n0.302186 0.272378 0.500000 H\n0.190787 0.525516 0.500000 H\n-0.000000 0.945151 0.000000 Pb\n0.500001 0.529021 0.500000 C\n0.500000 0.958176 0.000000 I\n-0.000000 0.444192 0.000000 I\n-0.000000 0.926661 0.500000 I\n0.679605 0.433572 0.500000 N\n0.320393 0.433572 0.500000 N\n",
"nsites": 12,
"nelements": 5,
"elements": [
"H",
"Pb",
"C",
"I",
"N"
],
"chemical_system": "C-H-I-N-Pb",
"density": 4.009214366087165,
"density_atomic": 0.04577236502641492,
"volume": 262.1669208719034,
"volume_molar": 13.156717500886536,
"formula_full": "H5 Pb1 C1 I3 N2",
"formula_reduced": "H5PbCI3N2",
"formula_anonymous": "ABC2D3E5",
"energy_above_hull": 2.8686113454166664,
"spacegroup": 25
},
{
"id": "jvasp-47725",
"created_at": "2022-09-04T14:38:33.289472Z",
"updated_at": "2022-09-04T14:38:33.289500Z",
"structure_string": "Li2 Fe2 P4 H2 O16\n1.0\n0.000000 4.757690 0.011371\n7.998810 0.000000 0.000000\n0.000000 -1.858020 -7.194030\nLi Fe P H O\n2 2 4 2 16\ndirect\n0.856562 0.625515 0.396615 Li\n0.143438 0.125515 0.603385 Li\n0.252087 0.499274 0.764451 Fe\n0.747913 -0.000726 0.235549 Fe\n0.879446 0.648576 0.011504 P\n0.120554 0.148576 0.988496 P\n0.377080 0.847442 0.501151 P\n0.622920 0.347442 0.498849 P\n0.717134 0.985804 0.736695 H\n0.282866 0.485804 0.263305 H\n0.607330 0.827859 0.385193 O\n0.499652 0.446619 0.316210 O\n0.378887 0.048154 0.113312 O\n0.209759 0.325514 0.948400 O\n0.500348 0.946619 0.683790 O\n0.392670 0.327859 0.614807 O\n0.106333 0.665080 0.890561 O\n0.893667 0.165080 0.109439 O\n0.263891 0.677961 0.542395 O\n0.124676 0.963327 0.396479 O\n0.000278 0.553620 0.190830 O\n0.736109 0.177961 0.457606 O\n0.790241 0.825514 0.051600 O\n0.875324 0.463327 0.603521 O\n0.999722 0.053620 0.809170 O\n0.621113 0.548154 0.886688 O\n",
"nsites": 26,
"nelements": 5,
"elements": [
"Li",
"Fe",
"P",
"H",
"O"
],
"chemical_system": "Fe-H-Li-O-P",
"density": 3.0799007069980275,
"density_atomic": 0.09502715881851383,
"volume": 273.60599141615614,
"volume_molar": 6.337283819567092,
"formula_full": "Li2 Fe2 P4 H2 O16",
"formula_reduced": "LiFeP2HO8",
"formula_anonymous": "ABCD2E8",
"energy_above_hull": 2.8732165,
"spacegroup": 4
}
]
}