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=-updated_at&page=874",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-updated_at&page=872",
"results": [
{
"id": "jvasp-117755",
"created_at": "2022-09-04T14:38:26.672546Z",
"updated_at": "2022-09-04T14:38:26.672573Z",
"structure_string": "Ca1 H1 Br1\n1.0\n4.650028 3.052330 0.000000\n3.761433 6.862117 0.000000\n0.000000 0.000000 4.743604\nCa H Br\n1 1 1\ndirect\n0.245363 0.015391 0.000000 Ca\n-0.041132 0.444997 0.000000 H\n0.118913 -0.275948 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ca",
"H",
"Br"
],
"chemical_system": "Br-Ca-H",
"density": 2.0733192465234085,
"density_atomic": 0.03095915333282075,
"volume": 96.90187479447663,
"volume_molar": 19.451890997341142,
"formula_full": "Ca1 H1 Br1",
"formula_reduced": "CaHBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.2929481750000002,
"spacegroup": 38
},
{
"id": "jvasp-119227",
"created_at": "2022-09-04T14:38:26.668427Z",
"updated_at": "2022-09-04T14:38:26.668456Z",
"structure_string": "Mg6 In4 N8\n1.0\n6.468749 -0.004316 -0.202800\n-6.005993 6.456493 -0.000001\n0.006284 0.005845 5.601520\nMg In N\n6 4 8\ndirect\n0.238823 0.018371 0.102311 Mg\n0.761177 0.779548 0.397689 Mg\n0.761177 0.981629 0.897689 Mg\n0.238823 0.220452 0.602311 Mg\n0.000000 0.710792 0.750000 Mg\n0.000000 0.289208 0.250000 Mg\n0.658682 0.450136 0.146282 In\n0.341318 0.791455 0.353718 In\n0.658682 0.208545 0.646282 In\n0.341318 0.549864 0.853718 In\n0.320296 0.773834 0.965650 N\n0.198021 0.950569 0.487375 N\n0.801978 0.752547 0.012625 N\n0.801978 0.049430 0.512625 N\n0.198021 0.247452 0.987375 N\n0.679704 0.226165 0.034350 N\n0.320296 0.546460 0.465650 N\n0.679704 0.453539 0.534350 N\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Mg",
"In",
"N"
],
"chemical_system": "In-Mg-N",
"density": 5.093082827027717,
"density_atomic": 0.07698227700535025,
"volume": 233.82005183802247,
"volume_molar": 7.822762581550378,
"formula_full": "Mg6 In4 N8",
"formula_reduced": "Mg3(InN2)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 2.205312232222222,
"spacegroup": 15
},
{
"id": "jvasp-112291",
"created_at": "2022-09-04T14:38:26.668297Z",
"updated_at": "2022-09-04T14:38:26.668327Z",
"structure_string": "Pr4 Si2 C2 N4 O8\n1.0\n6.209773 0.047341 1.930967\n1.731380 6.490113 0.546917\n0.010911 -0.030583 6.789360\nPr Si C N O\n4 2 2 4 8\ndirect\n0.543767 0.680307 0.214091 Pr\n0.456233 0.319693 0.785910 Pr\n0.935950 0.762326 0.668562 Pr\n0.064050 0.237674 0.331439 Pr\n0.041598 0.704336 0.185808 Si\n0.958401 0.295664 0.814193 Si\n0.434973 0.820962 0.695789 C\n0.565026 0.179038 0.304212 C\n0.641822 0.297500 0.374122 N\n0.358177 0.702499 0.625879 N\n0.479188 0.068553 0.237116 N\n0.520812 0.931447 0.762885 N\n0.886245 0.131609 0.697158 O\n0.113755 0.868391 0.302843 O\n0.139926 0.387394 0.626908 O\n0.860074 0.612606 0.373093 O\n0.908707 0.777416 0.016078 O\n0.091293 0.222584 0.983923 O\n0.725314 0.483046 0.886429 O\n0.274686 0.516954 0.113571 O\n",
"nsites": 20,
"nelements": 5,
"elements": [
"Pr",
"Si",
"C",
"N",
"O"
],
"chemical_system": "C-N-O-Pr-Si",
"density": 5.036628975475051,
"density_atomic": 0.07327769970631505,
"volume": 272.9343317292533,
"volume_molar": 8.218244819550488,
"formula_full": "Pr4 Si2 C2 N4 O8",
"formula_reduced": "Pr2SiC(NO2)2",
"formula_anonymous": "ABC2D2E4",
"energy_above_hull": 3.643589879999999,
"spacegroup": 2
},
{
"id": "jvasp-118674",
"created_at": "2022-09-04T14:38:26.662584Z",
"updated_at": "2022-09-04T14:38:26.662621Z",
"structure_string": "Mg2 C1\n1.0\n3.053457 0.000000 0.000000\n0.000000 3.053457 0.000000\n0.000000 0.000000 7.032464\nMg C\n2 1\ndirect\n0.000000 -0.000000 0.295280 Mg\n0.000000 -0.000000 0.704720 Mg\n0.000000 0.000000 0.000000 C\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Mg",
"C"
],
"chemical_system": "C-Mg",
"density": 1.53524930638411,
"density_atomic": 0.04575411086278707,
"volume": 65.56787889500816,
"volume_molar": 13.161966534679081,
"formula_full": "Mg2 C1",
"formula_reduced": "Mg2C",
"formula_anonymous": "AB2",
"energy_above_hull": 1.8113327,
"spacegroup": 123
},
{
"id": "jvasp-118647",
"created_at": "2022-09-04T14:38:26.653317Z",
"updated_at": "2022-09-04T14:38:26.653350Z",
"structure_string": "Na2 Al2 P2\n1.0\n4.376598 0.000000 -0.000000\n0.000000 4.376598 -0.000000\n0.000000 -0.000000 6.620091\nNa Al P\n2 2 2\ndirect\n0.000000 0.500001 0.631540 Na\n0.500001 0.000000 0.368459 Na\n0.000000 0.000000 0.000000 Al\n0.500001 0.500001 0.000000 Al\n0.000000 0.500001 0.190202 P\n0.500001 0.000000 0.809798 P\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Na",
"Al",
"P"
],
"chemical_system": "Al-Na-P",
"density": 2.11998223200813,
"density_atomic": 0.047316648561267056,
"volume": 126.80526162437339,
"volume_molar": 12.727318910176713,
"formula_full": "Na2 Al2 P2",
"formula_reduced": "NaAlP",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0646190999999998,
"spacegroup": 129
},
{
"id": "jvasp-112282",
"created_at": "2022-09-04T14:38:26.653003Z",
"updated_at": "2022-09-04T14:38:26.653031Z",
"structure_string": "Mn5 Cr1 O12\n1.0\n4.985606 0.002480 0.236159\n-2.512716 4.306104 0.236159\n0.402968 0.702103 8.942016\nMn Cr O\n5 1 12\ndirect\n0.166704 0.833352 0.499999 Mn\n0.666634 0.333295 0.000000 Mn\n0.333295 0.666633 0.000001 Mn\n0.833353 0.166704 0.499999 Mn\n0.500029 0.500029 0.499999 Mn\n-0.000036 -0.000036 0.000002 Cr\n0.700274 0.035734 0.892001 O\n0.628770 0.628769 0.108000 O\n-0.035804 0.299660 0.107998 O\n0.464239 0.130997 0.607884 O\n0.797749 0.797748 0.607907 O\n0.535817 0.869058 0.392118 O\n0.869059 0.535817 0.392118 O\n0.371159 0.371158 0.891999 O\n0.035734 0.700272 0.892001 O\n0.299660 -0.035803 0.107998 O\n0.130997 0.464238 0.607885 O\n0.202307 0.202307 0.392095 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Mn",
"Cr",
"O"
],
"chemical_system": "Cr-Mn-O",
"density": 4.52416235802783,
"density_atomic": 0.094550280177546,
"volume": 190.37489858517284,
"volume_molar": 6.369246869170198,
"formula_full": "Mn5 Cr1 O12",
"formula_reduced": "Mn5CrO12",
"formula_anonymous": "AB5C12",
"energy_above_hull": 3.735714200383142,
"spacegroup": 12
},
{
"id": "jvasp-112331",
"created_at": "2022-09-04T14:38:26.649646Z",
"updated_at": "2022-09-04T14:38:26.649667Z",
"structure_string": "Er4 Zn4 Rh4\n1.0\n3.984211 0.000000 0.000000\n0.000000 6.884303 0.000000\n0.000000 -0.000000 8.074660\nEr Zn Rh\n4 4 4\ndirect\n0.250000 0.540988 0.183024 Er\n0.750000 0.459012 0.816976 Er\n0.750000 0.959011 0.683024 Er\n0.250000 0.040988 0.316976 Er\n0.250000 0.635870 0.564203 Zn\n0.750000 0.364129 0.435797 Zn\n0.750000 0.864129 0.064203 Zn\n0.250000 0.135871 0.935797 Zn\n0.250000 0.751967 0.876271 Rh\n0.750000 0.248032 0.123729 Rh\n0.750000 0.748032 0.376271 Rh\n0.250000 0.251968 0.623729 Rh\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Er",
"Zn",
"Rh"
],
"chemical_system": "Er-Rh-Zn",
"density": 10.063989961558807,
"density_atomic": 0.05418195791087066,
"volume": 221.4759389046074,
"volume_molar": 11.114660658639218,
"formula_full": "Er4 Zn4 Rh4",
"formula_reduced": "ErZnRh",
"formula_anonymous": "ABC",
"energy_above_hull": 0.5265644666666669,
"spacegroup": 62
},
{
"id": "jvasp-118620",
"created_at": "2022-09-04T14:38:26.649617Z",
"updated_at": "2022-09-04T14:38:26.649648Z",
"structure_string": "Li2 O2\n1.0\n4.996117 -0.063173 0.400451\n-1.024330 -2.934013 0.174466\n-1.740843 -1.184119 -2.297503\nLi O\n2 2\ndirect\n0.043067 0.190320 0.085676 Li\n0.543047 -0.142672 0.252129 Li\n0.346793 0.522266 0.726488 O\n0.739195 0.526769 0.110709 O\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"O"
],
"chemical_system": "Li-O",
"density": 2.2866100247653747,
"density_atomic": 0.1200527230311842,
"volume": 33.3186944785999,
"volume_molar": 5.016246702239085,
"formula_full": "Li2 O2",
"formula_reduced": "LiO",
"formula_anonymous": "AB",
"energy_above_hull": 0.2204867499999998,
"spacegroup": 187
},
{
"id": "jvasp-118644",
"created_at": "2022-09-04T14:38:26.642255Z",
"updated_at": "2022-09-04T14:38:26.642276Z",
"structure_string": "Na2 Al1 O2\n1.0\n-1.396499 2.481941 4.876723\n1.396499 -2.481941 4.876723\n1.396499 2.481941 -4.876723\nNa Al O\n2 1 2\ndirect\n0.320591 0.820590 0.499999 Na\n0.679408 0.179409 0.499999 Na\n0.000000 0.499999 0.499999 Al\n0.128269 0.128269 -0.000000 O\n0.871730 0.871730 0.000000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Na",
"Al",
"O"
],
"chemical_system": "Al-Na-O",
"density": 2.5778179846667353,
"density_atomic": 0.07395198614334658,
"volume": 67.61143629473496,
"volume_molar": 8.143311727053336,
"formula_full": "Na2 Al1 O2",
"formula_reduced": "Na2AlO2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.6978535599999998,
"spacegroup": 71
},
{
"id": "jvasp-119243",
"created_at": "2022-09-04T14:38:26.642222Z",
"updated_at": "2022-09-04T14:38:26.642243Z",
"structure_string": "Ca4 Al2 Co2 O10\n1.0\n4.923781 -0.043712 -1.660218\n-0.577809 5.150446 -1.847419\n0.058227 0.045821 8.302747\nCa Al Co O\n4 2 2 10\ndirect\n0.116596 0.641544 0.218731 Ca\n0.398079 0.923004 0.781682 Ca\n0.898052 0.362354 0.781659 Ca\n0.616610 0.080904 0.218740 Ca\n0.293891 0.326390 0.500205 Al\n0.793904 0.677530 0.500207 Al\n0.496906 0.501950 0.000195 Co\n0.996916 0.001949 0.000195 Co\n0.262831 0.260834 0.025618 O\n0.237337 0.742988 0.974785 O\n0.822922 0.922319 0.706443 O\n0.116681 0.081594 0.293965 O\n0.635653 0.386847 0.500205 O\n0.616701 0.716112 0.293987 O\n0.135665 0.617064 0.500213 O\n0.762836 0.268485 0.025614 O\n0.322914 0.287803 0.706428 O\n0.737357 0.735494 0.974801 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Ca",
"Al",
"Co",
"O"
],
"chemical_system": "Al-Ca-Co-O",
"density": 3.867378543678905,
"density_atomic": 0.08518348938561524,
"volume": 211.30855439034906,
"volume_molar": 7.06961032405999,
"formula_full": "Ca4 Al2 Co2 O10",
"formula_reduced": "Ca2AlCoO5",
"formula_anonymous": "ABC2D5",
"energy_above_hull": 1.8228813377777775,
"spacegroup": 46
},
{
"id": "jvasp-112325",
"created_at": "2022-09-04T14:38:26.640503Z",
"updated_at": "2022-09-04T14:38:26.640534Z",
"structure_string": "Li2 Mg8 Sn2 O16\n1.0\n6.009494 0.000000 0.000000\n-3.004748 5.204374 0.000000\n-0.000000 -0.000000 9.987409\nLi Mg Sn O\n2 8 2 16\ndirect\n0.000000 0.000000 0.820423 Li\n0.000000 0.000000 0.320423 Li\n0.666666 0.333333 0.910395 Mg\n0.660518 0.830259 0.102620 Mg\n0.169740 0.830259 0.102620 Mg\n0.333333 0.666666 0.410395 Mg\n0.169740 0.339481 0.102620 Mg\n0.830259 0.169740 0.602620 Mg\n0.830259 0.660519 0.602620 Mg\n0.339481 0.169740 0.602620 Mg\n0.666666 0.333333 0.326461 Sn\n0.333333 0.666666 0.826461 Sn\n0.162949 0.325898 0.719771 O\n0.325898 0.162949 0.219771 O\n0.837050 0.162949 0.219771 O\n0.674101 0.837050 0.719771 O\n0.837050 0.674101 0.219771 O\n0.162948 0.837050 0.719771 O\n0.333333 0.666666 0.213829 O\n0.485232 0.514767 0.969681 O\n0.970464 0.485232 0.469681 O\n0.514767 0.485232 0.469681 O\n0.029535 0.514767 0.969681 O\n0.514767 0.029535 0.469681 O\n0.000000 0.000000 0.002679 O\n0.485231 0.970464 0.969681 O\n0.666666 0.333333 0.713829 O\n0.000000 0.000000 0.502679 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Mg",
"Sn",
"O"
],
"chemical_system": "Li-Mg-O-Sn",
"density": 3.7304514026996918,
"density_atomic": 0.08963936917954686,
"volume": 312.3627515039318,
"volume_molar": 6.718187349062783,
"formula_full": "Li2 Mg8 Sn2 O16",
"formula_reduced": "LiMg4SnO8",
"formula_anonymous": "ABC4D8",
"energy_above_hull": 1.3472004214285715,
"spacegroup": 186
},
{
"id": "jvasp-119236",
"created_at": "2022-09-04T14:38:26.638087Z",
"updated_at": "2022-09-04T14:38:26.638109Z",
"structure_string": "Cu2 Ge4 N6\n1.0\n5.526222 0.000443 0.000000\n-2.766444 4.787329 0.000000\n0.000000 0.000000 5.220579\nCu Ge N\n2 4 6\ndirect\n0.000001 0.661642 0.502850 Cu\n0.000000 0.338358 0.002850 Cu\n0.328601 0.330813 0.492142 Ge\n0.671399 0.002211 0.492142 Ge\n0.671399 0.669186 0.992142 Ge\n0.328601 0.997788 0.992142 Ge\n0.369040 0.334778 0.855493 N\n0.630961 0.965738 0.855493 N\n0.630961 0.665222 0.355493 N\n0.369039 0.034261 0.355493 N\n0.000001 0.694704 0.889881 N\n0.000000 0.305296 0.389881 N\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Cu",
"Ge",
"N"
],
"chemical_system": "Cu-Ge-N",
"density": 6.031510033468291,
"density_atomic": 0.08688020845319265,
"volume": 138.12121556390014,
"volume_molar": 6.931545017234245,
"formula_full": "Cu2 Ge4 N6",
"formula_reduced": "CuGe2N3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 3.07584035,
"spacegroup": 36
}
]
}