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=chemical_system&page=3377",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=chemical_system&page=3375",
"results": [
{
"id": "jvasp-88622",
"created_at": "2022-09-04T14:35:54.409612Z",
"updated_at": "2022-09-04T14:35:54.409634Z",
"structure_string": "Na4 P4 H8 O16\n1.0\n6.357498 0.019735 -1.987501\n-1.210324 9.146829 -2.233826\n-0.047198 -0.018228 6.311331\nNa P H O\n4 4 8 16\ndirect\n0.166719 0.869081 0.572866 Na\n0.833282 0.130919 0.427134 Na\n0.444763 0.591440 0.759748 Na\n0.555238 0.408561 0.240251 Na\n0.722386 0.911074 0.746925 P\n0.277614 0.088927 0.253075 P\n0.097831 0.784128 0.010833 P\n0.902170 0.215873 0.989167 P\n0.873798 0.569174 0.667240 H\n0.787971 0.425416 0.707872 H\n0.212030 0.574584 0.292128 H\n0.126203 0.430827 0.332760 H\n0.808677 0.651420 0.169576 H\n0.337398 0.267456 0.709105 H\n0.662602 0.732544 0.290894 H\n0.191324 0.348580 0.830424 H\n0.338671 0.357097 0.826302 O\n0.661330 0.642903 0.173698 O\n0.716174 0.077259 0.888876 O\n0.283826 0.922741 0.111124 O\n0.876267 0.304063 0.207603 O\n0.123734 0.695938 0.792397 O\n0.906882 0.284876 0.799789 O\n0.491174 0.172815 0.318136 O\n0.508826 0.827185 0.681863 O\n0.176167 0.084108 0.434325 O\n0.823833 0.915893 0.565674 O\n0.118029 0.141072 0.042445 O\n0.881971 0.858929 0.957555 O\n0.739917 0.508720 0.644081 O\n0.093118 0.715124 0.200211 O\n0.260083 0.491281 0.355919 O\n",
"nsites": 32,
"nelements": 4,
"elements": [
"Na",
"P",
"H",
"O"
],
"chemical_system": "H-Na-O-P",
"density": 2.177327265723393,
"density_atomic": 0.08743122462820851,
"volume": 366.0019648137884,
"volume_molar": 6.887860470453753,
"formula_full": "Na4 P4 H8 O16",
"formula_reduced": "NaP(HO2)2",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.2554510625,
"spacegroup": 2
},
{
"id": "jvasp-51374",
"created_at": "2022-09-04T14:36:59.804217Z",
"updated_at": "2022-09-04T14:36:59.804245Z",
"structure_string": "Na2 H6 Pt1 O6\n1.0\n2.919108 -5.056043 -0.000000\n2.919108 5.056043 0.000000\n0.000000 -0.000000 4.545928\nNa H Pt O\n2 6 1 6\ndirect\n0.666667 0.333334 0.054149 Na\n0.333333 0.666667 0.945851 Na\n0.667315 0.813644 0.411761 H\n0.186357 0.853672 0.411761 H\n0.146329 0.332685 0.411761 H\n0.332685 0.186357 0.588239 H\n0.813644 0.146329 0.588239 H\n0.853672 0.667315 0.588239 H\n0.000000 0.000000 0.000000 Pt\n0.698770 0.718523 0.250111 O\n0.281478 0.980246 0.250111 O\n0.019754 0.301231 0.250111 O\n0.301231 0.281477 0.749890 O\n0.718523 0.019754 0.749890 O\n0.980247 0.698770 0.749890 O\n",
"nsites": 15,
"nelements": 4,
"elements": [
"Na",
"H",
"Pt",
"O"
],
"chemical_system": "H-Na-O-Pt",
"density": 4.245862618281867,
"density_atomic": 0.11178352188137566,
"volume": 134.1879352836812,
"volume_molar": 5.38732423048066,
"formula_full": "Na2 H6 Pt1 O6",
"formula_reduced": "Na2H6PtO6",
"formula_anonymous": "AB2C6D6",
"energy_above_hull": 2.4981246933333336,
"spacegroup": 147
},
{
"id": "jvasp-98932",
"created_at": "2022-09-04T14:35:46.208492Z",
"updated_at": "2022-09-04T14:35:46.208517Z",
"structure_string": "Na8 H16 S8 O32\n1.0\n6.416399 0.000000 -0.000000\n0.000000 10.639703 0.000000\n0.000000 0.000000 10.516697\nNa H S O\n8 16 8 32\ndirect\n0.563744 0.059440 0.653774 Na\n0.063744 0.440560 0.846226 Na\n0.436256 0.559440 0.346226 Na\n0.936256 0.940560 0.153774 Na\n0.436256 0.940560 0.346226 Na\n0.936256 0.559440 0.153774 Na\n0.563744 0.440560 0.653774 Na\n0.063744 0.059440 0.846226 Na\n0.215940 0.124719 0.227165 H\n0.715940 0.375281 0.272835 H\n0.784060 0.624719 0.772835 H\n0.284060 0.875281 0.727165 H\n0.784060 0.875281 0.772835 H\n0.284060 0.624719 0.727165 H\n0.215940 0.375281 0.227165 H\n0.715940 0.124719 0.272835 H\n0.681021 0.568224 0.895347 H\n0.818979 0.431775 0.395347 H\n0.181021 0.931775 0.604653 H\n0.681021 0.931775 0.895347 H\n0.181021 0.568224 0.604653 H\n0.318979 0.431775 0.104653 H\n0.818979 0.068225 0.395347 H\n0.318979 0.068225 0.104653 H\n0.992396 0.250000 0.591667 S\n0.507605 0.750000 0.091667 S\n0.492396 0.250000 0.908333 S\n0.007605 0.750000 0.408333 S\n0.246278 0.750000 0.954479 S\n0.253722 0.250000 0.454479 S\n0.753722 0.250000 0.045521 S\n0.746279 0.750000 0.545521 S\n0.620282 0.866508 0.061647 O\n0.120282 0.633491 0.438353 O\n0.379718 0.366508 0.938353 O\n0.879718 0.133492 0.561647 O\n0.585390 0.250000 0.780473 O\n0.085390 0.250000 0.719527 O\n0.914610 0.750000 0.280473 O\n0.756153 0.044835 0.313541 O\n0.256153 0.455165 0.186459 O\n0.243847 0.544835 0.686459 O\n0.743847 0.955165 0.813541 O\n0.243847 0.955165 0.686459 O\n0.743847 0.544835 0.813541 O\n0.414610 0.750000 0.219527 O\n0.120282 0.866508 0.438353 O\n0.879718 0.366508 0.561647 O\n0.379718 0.133492 0.938353 O\n0.856937 0.750000 0.668817 O\n0.356937 0.750000 0.831184 O\n0.143063 0.250000 0.331183 O\n0.643063 0.250000 0.168817 O\n0.370590 0.134151 0.478367 O\n0.870590 0.365849 0.021633 O\n0.629410 0.634151 0.521633 O\n0.129410 0.865849 0.978367 O\n0.629410 0.865849 0.521633 O\n0.129410 0.634151 0.978367 O\n0.370590 0.365849 0.478367 O\n0.870590 0.134151 0.021633 O\n0.756153 0.455165 0.313541 O\n0.620282 0.633491 0.061647 O\n0.256153 0.044835 0.186459 O\n",
"nsites": 64,
"nelements": 4,
"elements": [
"Na",
"H",
"S",
"O"
],
"chemical_system": "H-Na-O-S",
"density": 2.240108828732642,
"density_atomic": 0.08914146041913357,
"volume": 717.9599672147941,
"volume_molar": 6.755712472831993,
"formula_full": "Na8 H16 S8 O32",
"formula_reduced": "NaH2SO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.147715375,
"spacegroup": 62
},
{
"id": "jvasp-52841",
"created_at": "2022-09-04T14:36:37.125411Z",
"updated_at": "2022-09-04T14:36:37.125438Z",
"structure_string": "Na2 H6 S2 O10\n1.0\n3.369743 3.873931 -1.947130\n-3.369743 3.873931 1.947130\n-0.038891 0.000000 8.163178\nNa H S O\n2 6 2 10\ndirect\n0.948420 0.496464 0.491771 Na\n0.503535 0.051580 0.991771 Na\n0.303088 0.597284 0.780343 H\n0.402716 0.696912 0.280343 H\n0.495723 0.528869 0.695130 H\n0.471131 0.504277 0.195130 H\n0.822907 0.591537 0.002184 H\n0.408463 0.177093 0.502184 H\n0.126038 0.137416 0.244790 S\n0.862583 0.873962 0.744790 S\n0.355005 0.462141 0.740768 O\n0.775365 0.687047 0.653099 O\n0.312953 0.224635 0.153099 O\n0.717991 0.141306 0.629014 O\n0.858693 0.282009 0.129013 O\n0.777750 0.789495 0.922039 O\n0.210505 0.222250 0.422039 O\n0.146967 0.870891 0.813862 O\n0.129109 0.853033 0.313862 O\n0.537858 0.644995 0.240768 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Na",
"H",
"S",
"O"
],
"chemical_system": "H-Na-O-S",
"density": 2.1575222675452213,
"density_atomic": 0.09409992642605199,
"volume": 212.54001740072468,
"volume_molar": 6.399729509600067,
"formula_full": "Na2 H6 S2 O10",
"formula_reduced": "NaH3SO5",
"formula_anonymous": "ABC3D5",
"energy_above_hull": 2.37123365,
"spacegroup": 9
},
{
"id": "jvasp-52876",
"created_at": "2022-09-04T14:36:47.554239Z",
"updated_at": "2022-09-04T14:36:47.554266Z",
"structure_string": "Na2 H6 Se4 O12\n1.0\n0.000000 4.511503 0.034681\n5.980315 0.000000 0.000000\n0.000000 -3.868929 -10.373610\nNa H Se O\n2 6 4 12\ndirect\n-0.000000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Na\n-0.000000 0.000000 0.500000 H\n0.000000 0.500000 0.000000 H\n0.790065 0.554348 0.686561 H\n0.790065 0.945653 0.186561 H\n0.209934 0.445653 0.313439 H\n0.209934 0.054347 0.813439 H\n0.311085 0.887571 0.343074 Se\n0.311085 0.612430 0.843074 Se\n0.688914 0.112430 0.656927 Se\n0.688914 0.387571 0.156926 Se\n0.964123 0.826714 0.199080 O\n0.849941 0.361425 0.035135 O\n0.849941 0.138576 0.535135 O\n0.150058 0.638576 0.964865 O\n0.150058 0.861425 0.464865 O\n0.525290 0.131120 0.145891 O\n0.525289 0.368880 0.645892 O\n0.474710 0.868881 0.854109 O\n0.474710 0.631120 0.354109 O\n0.035877 0.173286 0.800920 O\n0.035877 0.326714 0.300920 O\n0.964122 0.673287 0.699080 O\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Na",
"H",
"Se",
"O"
],
"chemical_system": "H-Na-O-Se",
"density": 3.331196213944068,
"density_atomic": 0.08599692755212562,
"volume": 279.0797378831098,
"volume_molar": 7.002739436649964,
"formula_full": "Na2 H6 Se4 O12",
"formula_reduced": "NaH3(SeO3)2",
"formula_anonymous": "AB2C3D6",
"energy_above_hull": 2.3783247277777777,
"spacegroup": 14
},
{
"id": "jvasp-85686",
"created_at": "2022-09-04T14:36:02.609312Z",
"updated_at": "2022-09-04T14:36:02.609326Z",
"structure_string": "Na2 Zn1 H4 Se2 O10\n1.0\n5.718319 -0.007489 -1.803163\n-2.683877 6.545901 -1.110686\n-0.083518 0.000340 5.584505\nNa Zn H Se O\n2 1 4 2 10\ndirect\n0.723696 0.247627 0.346428 Na\n0.276303 0.752372 0.653573 Na\n0.000000 0.000000 0.000000 Zn\n0.871276 0.607841 0.853496 H\n0.128723 0.392159 0.146505 H\n0.154422 0.701474 0.078377 H\n0.845577 0.298526 0.921624 H\n0.661036 0.758760 0.324090 Se\n0.338963 0.241240 0.675911 Se\n0.641580 0.371568 0.716348 O\n0.358419 0.628432 0.283653 O\n0.175180 0.389574 0.655124 O\n0.824819 0.610425 0.344877 O\n0.652523 0.862777 0.070823 O\n0.773256 0.954916 0.594958 O\n0.347476 0.137223 0.929177 O\n0.037084 0.727898 0.925720 O\n0.226743 0.045083 0.405042 O\n0.962915 0.272102 0.074280 O\n",
"nsites": 19,
"nelements": 5,
"elements": [
"Na",
"Zn",
"H",
"Se",
"O"
],
"chemical_system": "H-Na-O-Se-Zn",
"density": 3.460433143321408,
"density_atomic": 0.09137174130133432,
"volume": 207.94175233390828,
"volume_molar": 6.590813170715023,
"formula_full": "Na2 Zn1 H4 Se2 O10",
"formula_reduced": "Na2ZnH4(SeO5)2",
"formula_anonymous": "AB2C2D4E10",
"energy_above_hull": 2.2064184280701755,
"spacegroup": 2
},
{
"id": "jvasp-98627",
"created_at": "2022-09-04T14:36:11.695811Z",
"updated_at": "2022-09-04T14:36:11.695823Z",
"structure_string": "Na8 Si12 H8 O32\n1.0\n6.387509 0.000000 -3.568703\n0.000000 12.762272 0.000000\n-0.049916 0.000000 9.064179\nNa Si H O\n8 12 8 32\ndirect\n0.143069 0.668779 0.495063 Na\n0.856931 0.168779 0.004937 Na\n0.856931 0.331221 0.504937 Na\n0.143068 0.831221 0.995063 Na\n0.291801 0.076436 0.963583 Na\n0.708198 0.576436 0.536417 Na\n0.708199 0.923564 0.036417 Na\n0.291801 0.423564 0.463583 Na\n0.225043 0.370086 0.066516 Si\n0.774957 0.870086 0.433485 Si\n0.774956 0.629914 0.933485 Si\n0.225043 0.129914 0.566516 Si\n0.361798 0.304830 0.814404 Si\n0.638201 0.804830 0.685596 Si\n0.253658 0.604610 0.183250 Si\n0.361798 0.195170 0.314404 Si\n0.746342 0.104610 0.316751 Si\n0.746342 0.395390 0.816751 Si\n0.253658 0.895390 0.683250 Si\n0.638202 0.695170 0.185596 Si\n0.793706 0.099749 0.672416 H\n0.206294 0.900251 0.327584 H\n0.793706 0.400251 0.172416 H\n0.206293 0.599749 0.827584 H\n0.840670 0.002599 0.793545 H\n0.840671 0.497400 0.293545 H\n0.159329 0.502599 0.706456 H\n0.159329 0.997400 0.206456 H\n0.628342 0.685254 0.000154 O\n0.628341 0.814745 0.500154 O\n0.371658 0.314745 -0.000154 O\n0.390302 0.810209 0.638329 O\n0.609697 0.310209 0.861671 O\n0.609697 0.189791 0.361671 O\n0.288667 0.318807 0.251955 O\n0.711333 0.818807 0.248045 O\n0.711333 0.681192 0.748045 O\n0.288666 0.181192 0.751955 O\n0.118123 0.578465 0.709812 O\n0.881877 0.078465 0.790189 O\n0.371658 0.185255 0.499846 O\n0.390302 0.689791 0.138329 O\n0.018412 0.658402 0.067904 O\n0.675475 0.411094 0.623021 O\n0.981588 0.341597 0.932096 O\n0.018412 0.841597 0.567904 O\n0.209295 0.385241 0.673531 O\n0.790705 0.885241 0.826469 O\n0.790705 0.614759 0.326469 O\n0.209295 0.114759 0.173531 O\n0.259131 0.495769 0.085035 O\n0.740869 0.995769 0.414965 O\n0.740869 0.504231 0.914965 O\n0.259131 0.004231 0.585035 O\n0.324524 0.588905 0.376979 O\n0.675476 0.088905 0.123021 O\n0.881877 0.421535 0.290189 O\n0.324524 0.911094 0.876979 O\n0.981588 0.158403 0.432096 O\n0.118123 0.921535 0.209812 O\n",
"nsites": 60,
"nelements": 4,
"elements": [
"Na",
"Si",
"H",
"O"
],
"chemical_system": "H-Na-O-Si",
"density": 2.3466336430216694,
"density_atomic": 0.08145195724071182,
"volume": 736.6305492535228,
"volume_molar": 7.393488092868044,
"formula_full": "Na8 Si12 H8 O32",
"formula_reduced": "Na2Si3(HO4)2",
"formula_anonymous": "A2B2C3D8",
"energy_above_hull": 2.525261453333333,
"spacegroup": 14
},
{
"id": "jvasp-85687",
"created_at": "2022-09-04T14:36:12.656854Z",
"updated_at": "2022-09-04T14:36:12.656865Z",
"structure_string": "Na2 Sn1 H6 O6\n1.0\n2.974541 1.717353 4.694902\n-2.974541 1.717353 4.694902\n0.000000 -3.434704 4.694902\nNa Sn H O\n2 1 6 6\ndirect\n0.667210 0.667210 0.667210 Na\n0.332790 0.332790 0.332790 Na\n0.000000 0.000000 0.000000 Sn\n0.868736 0.386348 0.188558 H\n0.386348 0.188558 0.868736 H\n0.188558 0.868736 0.386348 H\n0.131264 0.613652 0.811442 H\n0.613651 0.811442 0.131264 H\n0.811442 0.131264 0.613652 H\n0.376013 0.083932 0.784699 O\n0.083931 0.784699 0.376013 O\n0.784699 0.376013 0.083932 O\n0.623986 0.916068 0.215301 O\n0.916068 0.215300 0.623987 O\n0.215300 0.623987 0.916068 O\n",
"nsites": 15,
"nelements": 4,
"elements": [
"Na",
"Sn",
"H",
"O"
],
"chemical_system": "H-Na-O-Sn",
"density": 3.078007284888335,
"density_atomic": 0.10423993055005874,
"volume": 143.89879119112237,
"volume_molar": 5.777191838311913,
"formula_full": "Na2 Sn1 H6 O6",
"formula_reduced": "Na2Sn(HO)6",
"formula_anonymous": "AB2C6D6",
"energy_above_hull": 2.301532046666667,
"spacegroup": 148
},
{
"id": "jvasp-98636",
"created_at": "2022-09-04T14:36:17.952139Z",
"updated_at": "2022-09-04T14:36:17.952152Z",
"structure_string": "Na8 Te4 H40 O32\n1.0\n6.677936 3.678778 -0.847417\n-6.677936 3.678778 0.847417\n0.104157 0.000000 17.021862\nNa Te H O\n8 4 40 32\ndirect\n0.469051 0.564037 0.575156 Na\n0.564037 0.469051 0.924844 Na\n0.530950 0.435963 0.424844 Na\n0.435963 0.530949 0.075156 Na\n0.516372 0.516371 0.750000 Na\n0.483629 0.483629 0.250000 Na\n0.000000 0.500000 0.500000 Na\n0.500000 -0.000000 -0.000000 Na\n0.147325 0.825570 0.183255 Te\n0.825570 0.147325 0.316745 Te\n0.852676 0.174430 0.816745 Te\n0.174431 0.852675 0.683255 Te\n0.875270 0.768186 0.342713 H\n0.768186 0.875270 0.157287 H\n0.832045 0.843293 0.455188 H\n0.843293 0.832045 0.044812 H\n0.167956 0.156707 0.544812 H\n0.156707 0.167955 0.955188 H\n0.874138 0.805236 0.545536 H\n0.125863 0.194764 0.454464 H\n0.588076 0.911045 0.655866 H\n0.795906 0.901209 0.655619 H\n0.901209 0.795906 0.844381 H\n0.204095 0.098791 0.344381 H\n0.098791 0.204095 0.155619 H\n0.231814 0.124730 0.842713 H\n0.911045 0.588076 0.844134 H\n0.411924 0.088956 0.344134 H\n0.088956 0.411924 0.155866 H\n0.194764 0.125862 0.045536 H\n0.124730 0.231814 0.657287 H\n0.805236 0.874138 0.954463 H\n0.877771 0.556792 0.340050 H\n0.556792 0.877770 0.159950 H\n0.774418 0.469308 0.646701 H\n0.469309 0.774418 0.853299 H\n0.530692 0.225583 0.146701 H\n0.554886 0.253250 0.647318 H\n0.253251 0.554886 0.852682 H\n0.445115 0.746750 0.352682 H\n0.746750 0.445115 0.147318 H\n0.432964 0.840471 0.458918 H\n0.225583 0.530692 0.353299 H\n0.567037 0.159529 0.541082 H\n0.159530 0.567036 0.958918 H\n0.366013 0.851294 0.543598 H\n0.851295 0.366013 0.956402 H\n0.633988 0.148706 0.456402 H\n0.148706 0.633987 0.043598 H\n0.122230 0.443208 0.659950 H\n0.840471 0.432964 0.041082 H\n0.443209 0.122230 0.840050 H\n0.755959 0.341671 0.997728 O\n0.733545 0.780757 0.000942 O\n0.219244 0.266456 0.500942 O\n0.266456 0.219244 0.999058 O\n0.651973 0.828592 0.673527 O\n0.828593 0.651973 0.826473 O\n0.348027 0.171408 0.326473 O\n0.376772 0.595943 0.345760 O\n0.623228 0.404057 0.654240 O\n0.404058 0.623228 0.845759 O\n0.595943 0.376772 0.154240 O\n0.341671 0.755959 0.502272 O\n0.780757 0.733544 0.499058 O\n0.171408 0.348027 0.173527 O\n0.622331 0.794257 0.172598 O\n0.992655 0.420561 0.874260 O\n0.377670 0.205743 0.827402 O\n0.205743 0.377669 0.672597 O\n0.402497 0.968547 0.134035 O\n0.968547 0.402497 0.365965 O\n0.597503 0.031454 0.865965 O\n0.031454 0.597503 0.634035 O\n0.007345 0.579440 0.125740 O\n0.579440 0.007345 0.374260 O\n0.420561 0.992655 0.625740 O\n0.023792 0.962446 0.125514 O\n0.962447 0.023792 0.374486 O\n0.976208 0.037554 0.874486 O\n0.037554 0.976208 0.625514 O\n0.658329 0.244042 0.497728 O\n0.794258 0.622331 0.327402 O\n0.244042 0.658329 0.002272 O\n",
"nsites": 84,
"nelements": 4,
"elements": [
"Na",
"Te",
"H",
"O"
],
"chemical_system": "H-Na-O-Te",
"density": 2.4732157201082825,
"density_atomic": 0.10035968675928437,
"volume": 836.9894597367212,
"volume_molar": 6.000557549012961,
"formula_full": "Na8 Te4 H40 O32",
"formula_reduced": "Na2Te(H5O4)2",
"formula_anonymous": "AB2C8D10",
"energy_above_hull": 2.6292777984126987,
"spacegroup": 15
},
{
"id": "jvasp-51745",
"created_at": "2022-09-04T14:37:33.026650Z",
"updated_at": "2022-09-04T14:37:33.026666Z",
"structure_string": "Na3 V1 H6 O7\n1.0\n4.236970 2.446216 2.595575\n-4.236970 2.446216 2.595575\n-0.000000 -4.892430 2.595575\nNa V H O\n3 1 6 7\ndirect\n0.624145 0.429621 0.179598 Na\n0.429621 0.179598 0.624144 Na\n0.179599 0.624145 0.429620 Na\n0.997650 0.997650 0.997649 V\n0.608830 0.922759 0.254285 H\n0.922759 0.254286 0.608829 H\n0.254286 0.608830 0.922758 H\n0.511546 0.752743 0.880663 H\n0.880664 0.511546 0.752741 H\n0.752743 0.880665 0.511545 H\n0.396452 0.582710 0.837405 O\n0.218109 0.218109 0.218108 O\n0.998384 0.693698 0.046306 O\n0.693697 0.046307 0.998383 O\n0.046307 0.998384 0.693697 O\n0.837406 0.396452 0.582709 O\n0.582710 0.837406 0.396451 O\n",
"nsites": 17,
"nelements": 4,
"elements": [
"Na",
"V",
"H",
"O"
],
"chemical_system": "H-Na-O-V",
"density": 2.447978806448716,
"density_atomic": 0.105320767546855,
"volume": 161.41166073858184,
"volume_molar": 5.7179043604300315,
"formula_full": "Na3 V1 H6 O7",
"formula_reduced": "Na3VH6O7",
"formula_anonymous": "AB3C6D7",
"energy_above_hull": 2.44849504117647,
"spacegroup": 146
},
{
"id": "jvasp-51748",
"created_at": "2022-09-04T14:36:35.321062Z",
"updated_at": "2022-09-04T14:36:35.321078Z",
"structure_string": "Na1 H2 Pd3\n1.0\n2.849128 4.327882 0.000000\n-2.849128 4.327882 0.000000\n0.000000 0.000000 2.839602\nNa H Pd\n1 2 3\ndirect\n0.500000 0.500000 0.000000 Na\n0.784922 0.784922 0.000000 H\n0.215078 0.215078 0.000000 H\n0.000000 0.000000 0.000000 Pd\n-0.000000 0.500000 0.500000 Pd\n0.500000 -0.000000 0.500000 Pd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Na",
"H",
"Pd"
],
"chemical_system": "H-Na-Pd",
"density": 8.163341173707272,
"density_atomic": 0.08567939858032249,
"volume": 70.02850276049891,
"volume_molar": 7.028691680596217,
"formula_full": "Na1 H2 Pd3",
"formula_reduced": "NaH2Pd3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.7167176833333335,
"spacegroup": 65
},
{
"id": "jvasp-51744",
"created_at": "2022-09-04T14:38:16.186897Z",
"updated_at": "2022-09-04T14:38:16.186925Z",
"structure_string": "Na2 H4 Pd1\n1.0\n-2.640708 2.640708 3.273443\n2.640708 -2.640708 3.273443\n2.640708 2.640708 -3.273443\nNa H Pd\n2 4 1\ndirect\n0.750000 0.250000 0.500000 Na\n0.250000 0.750000 0.500000 Na\n0.222249 0.222249 0.444496 H\n0.777751 0.777751 0.555505 H\n0.222248 0.777751 0.000000 H\n0.777751 0.222248 0.000000 H\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 7,
"nelements": 3,
"elements": [
"Na",
"H",
"Pd"
],
"chemical_system": "H-Na-Pd",
"density": 2.844901349610343,
"density_atomic": 0.07666418151295842,
"volume": 91.3073075568778,
"volume_molar": 7.855220836058997,
"formula_full": "Na2 H4 Pd1",
"formula_reduced": "Na2H4Pd",
"formula_anonymous": "AB2C4",
"energy_above_hull": 1.678071957142857,
"spacegroup": 139
}
]
}