{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-elements&page=583","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-elements&page=581","results":[{"id":"jvasp-51765","created_at":"2022-09-04T14:37:03.995261Z","updated_at":"2022-09-04T14:37:03.995294Z","structure_string":"H8 Pd1 N2 Cl6\n1.0\n4.879412 4.879412 0.000000\n-0.000000 4.879412 4.879412\n4.879412 -0.000000 4.879412\nH Pd N Cl\n8 1 2 6\ndirect\n0.933839 0.688720 0.688720 H\n0.311280 0.311280 0.311280 H\n0.311280 0.066161 0.311280 H\n0.311280 0.311280 0.066161 H\n0.000000 0.000000 0.000000 H\n0.688720 0.688720 0.688720 H\n0.688720 0.933839 0.688720 H\n0.688720 0.688720 0.933839 H\n0.066161 0.311280 0.311280 Pd\n0.750000 0.750000 0.750000 N\n0.250000 0.250000 0.250000 N\n0.759335 0.759335 0.240665 Cl\n0.240665 0.759335 0.759335 Cl\n0.240665 0.240665 0.759335 Cl\n0.240665 0.759335 0.240665 Cl\n0.759335 0.240665 0.240665 Cl\n0.759335 0.240665 0.759335 Cl\n","nsites":17,"nelements":4,"elements":["H","Pd","N","Cl"],"chemical_system":"Cl-H-N-Pd","density":2.5386792369594304,"density_atomic":0.07316720343577364,"volume":232.34453691977777,"volume_molar":8.230655918517167,"formula_full":"H8 Pd1 N2 Cl6","formula_reduced":"H8Pd(NCl3)2","formula_anonymous":"AB2C6D8","energy_above_hull":2.4095450944117647,"spacegroup":160},{"id":"jvasp-31945","created_at":"2022-09-04T14:37:07.125231Z","updated_at":"2022-09-04T14:37:07.125257Z","structure_string":"H16 Pd2 N4 Cl12\n1.0\n6.852939 0.000000 -0.011520\n0.000000 6.846831 0.000000\n-0.006057 0.000000 10.010517\nH Pd N Cl\n16 2 4 12\ndirect\n0.849205 0.522786 0.245341 H\n0.000000 0.000000 0.000000 H\n0.434272 0.056565 0.334174 H\n0.934273 0.443435 0.834174 H\n0.565727 0.943435 0.665826 H\n0.065728 0.556565 0.165826 H\n0.476654 0.849981 0.244379 H\n0.976654 0.650019 0.744379 H\n0.523345 0.150019 0.755621 H\n0.500000 0.500000 0.500000 H\n0.444067 0.067059 0.165112 H\n0.944066 0.432941 0.665112 H\n0.555933 0.932941 0.834889 H\n0.055933 0.567059 0.334889 H\n0.650795 0.022786 0.254659 H\n0.150794 0.477214 0.754659 H\n0.023346 0.349981 0.255621 Pd\n0.349205 0.977214 0.745341 Pd\n0.001278 0.500670 0.749604 N\n0.501279 -0.000670 0.249604 N\n-0.001279 0.499330 0.250397 N\n0.498721 0.000670 0.750397 N\n0.493219 0.495052 0.734723 Cl\n0.237007 0.719844 0.497531 Cl\n0.737007 0.780156 0.997531 Cl\n0.762993 0.280156 0.502469 Cl\n0.262993 0.219844 0.002469 Cl\n0.280407 0.236796 0.495138 Cl\n0.780407 0.263204 0.995138 Cl\n0.719592 0.763204 0.504863 Cl\n0.219592 0.736796 0.004862 Cl\n0.506781 0.504947 0.265278 Cl\n0.006780 0.995052 0.765278 Cl\n0.993219 0.004947 0.234723 Cl\n","nsites":34,"nelements":4,"elements":["H","Pd","N","Cl"],"chemical_system":"Cl-H-N-Pd","density":2.5115842562145945,"density_atomic":0.07238629975192731,"volume":469.7021413792426,"volume_molar":8.319448266644764,"formula_full":"H16 Pd2 N4 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O\n","nsites":16,"nelements":4,"elements":["H","Pb","I","O"],"chemical_system":"H-I-O-Pb","density":6.672389485138566,"density_atomic":0.04577694917061826,"volume":349.5208896592334,"volume_molar":13.155399975552074,"formula_full":"H4 Pb4 I4 O4","formula_reduced":"HPbIO","formula_anonymous":"ABCD","energy_above_hull":0.97689264875,"spacegroup":62},{"id":"jvasp-52861","created_at":"2022-09-04T14:36:59.349962Z","updated_at":"2022-09-04T14:36:59.349975Z","structure_string":"H4 Pb4 Cl4 O4\n1.0\n4.039183 0.000000 0.000000\n-0.000000 7.105200 0.000000\n0.000000 0.000000 9.786385\nH Pb Cl O\n4 4 4 4\ndirect\n0.250000 0.720610 0.616838 H\n0.250000 0.220610 0.883163 H\n0.749999 0.279390 0.383163 H\n0.749999 0.779390 0.116838 H\n0.250000 0.294857 0.589448 Pb\n0.250000 0.794857 0.910552 Pb\n0.749999 0.705143 0.410552 Pb\n0.749999 0.205143 0.089448 Pb\n0.250000 0.056418 0.322155 Cl\n0.250000 0.556418 0.177845 Cl\n0.749999 0.943582 0.677845 Cl\n0.749999 0.443582 0.822156 Cl\n0.250000 0.630289 0.541145 O\n0.250000 0.130289 0.958856 O\n0.749999 0.369711 0.458856 O\n0.749999 0.869711 0.041145 O\n","nsites":16,"nelements":4,"elements":["H","Pb","Cl","O"],"chemical_system":"Cl-H-O-Pb","density":6.140766391734091,"density_atomic":0.056967590195837664,"volume":280.86145025613246,"volume_molar":10.571169921876049,"formula_full":"H4 Pb4 Cl4 O4","formula_reduced":"HPbClO","formula_anonymous":"ABCD","energy_above_hull":1.029007096875,"spacegroup":62},{"id":"jvasp-85663","created_at":"2022-09-04T14:35:50.701878Z","updated_at":"2022-09-04T14:35:50.701893Z","structure_string":"H2 Pb2 Cl2 O2\n1.0\n4.856904 2.008592 -2.487160\n-4.856904 2.008592 2.487160\n0.016399 0.000000 7.266492\nH Pb Cl O\n2 2 2 2\ndirect\n0.883825 0.116174 0.388459 H\n0.116174 0.883825 0.611541 H\n0.827958 0.172041 0.761773 Pb\n0.172041 0.827958 0.238226 Pb\n0.568259 0.431740 0.814621 Cl\n0.431740 0.568259 0.185379 Cl\n0.801975 0.198024 0.411692 O\n0.198024 0.801975 0.588308 O\n","nsites":8,"nelements":4,"elements":["H","Pb","Cl","O"],"chemical_system":"Cl-H-O-Pb","density":6.075430489995903,"density_atomic":0.05636147222328188,"volume":141.9409338405349,"volume_molar":10.68485353991936,"formula_full":"H2 Pb2 Cl2 O2","formula_reduced":"HPbClO","formula_anonymous":"ABCD","energy_above_hull":1.0291070968749998,"spacegroup":12},{"id":"jvasp-112125","created_at":"2022-09-04T14:38:41.706789Z","updated_at":"2022-09-04T14:38:41.706806Z","structure_string":"H16 Pb2 C12 O8\n1.0\n4.290578 0.114077 0.391140\n1.446163 7.646215 1.750649\n0.032281 0.035410 10.787550\nH Pb C O\n16 2 12 8\ndirect\n0.321520 0.834320 0.316276 H\n0.872302 0.124590 0.698588 H\n0.873023 0.625132 0.698322 H\n0.782904 0.357293 0.658893 H\n0.781968 0.857813 0.658889 H\n0.298057 0.855420 0.548529 H\n0.370029 0.124008 0.592088 H\n0.370500 0.623768 0.592178 H\n0.298382 0.355656 0.548507 H\n0.824043 0.835747 0.422403 H\n0.896201 0.103860 0.466085 H\n0.896548 0.604095 0.466063 H\n0.411679 0.102180 0.355720 H\n0.412657 0.601641 0.355723 H\n0.322244 0.334883 0.316003 H\n0.824506 0.335508 0.422495 H\n0.098076 0.479679 0.007217 Pb\n0.096540 0.979824 0.007386 Pb\n0.676387 0.240344 0.680367 C\n0.468849 0.248215 0.801056 C\n0.469345 0.747647 0.801203 C\n0.489065 0.236419 0.567173 C\n0.489093 0.736346 0.567194 C\n0.676406 0.740533 0.680322 C\n0.725229 0.711833 0.213396 C\n0.705484 0.723156 0.447397 C\n0.518173 0.219137 0.334231 C\n0.518173 0.718938 0.334277 C\n0.725717 0.211252 0.213546 C\n0.705496 0.223087 0.447418 C\n0.555909 0.632964 0.903793 O\n0.981644 0.595866 0.215282 O\n0.981318 0.094639 0.215810 O\n0.638657 0.826504 0.110803 O\n0.640342 0.325777 0.110761 O\n0.212951 0.863628 0.799321 O\n0.213243 0.364823 0.798806 O\n0.554245 0.133678 0.903833 O\n","nsites":38,"nelements":4,"elements":["H","Pb","C","O"],"chemical_system":"C-H-O-Pb","density":3.316710041730934,"density_atomic":0.10801959848152166,"volume":351.7880137880762,"volume_molar":5.575044570296358,"formula_full":"H16 Pb2 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C\n0.608055 0.262673 0.990466 C\n0.047005 0.376741 0.725419 O\n0.446570 0.775304 0.688733 O\n0.688015 0.346541 0.901642 O\n0.391761 0.012634 -0.000386 O\n","nsites":25,"nelements":4,"elements":["H","Pb","C","O"],"chemical_system":"C-H-O-Pb","density":2.875007763954805,"density_atomic":0.1140925379228939,"volume":219.12037767882347,"volume_molar":5.278295031064949,"formula_full":"H12 Pb1 C8 O4","formula_reduced":"H12Pb(C2O)4","formula_anonymous":"AB4C8D12","energy_above_hull":4.5315517928,"spacegroup":1},{"id":"jvasp-104015","created_at":"2022-09-04T14:36:54.250589Z","updated_at":"2022-09-04T14:36:54.250613Z","structure_string":"H20 Pb1 C12 O4\n1.0\n3.838345 -0.200944 -0.361401\n-0.396977 4.922657 -0.378883\n0.398266 0.881922 15.875281\nH Pb C O\n20 1 12 4\ndirect\n0.495643 0.562487 0.402388 H\n0.891783 0.306019 0.487460 H\n0.160343 0.307341 0.929779 H\n0.580050 0.286963 0.978262 H\n0.377820 0.420868 0.781001 H\n0.815174 0.391778 0.815746 H\n0.595615 0.585239 0.633460 H\n0.037141 0.574712 0.668492 H\n0.797969 0.794982 0.492739 H\n0.241193 0.795116 0.527707 H\n-0.015361 0.046322 0.354543 H\n0.428161 0.041227 0.389054 H\n0.377331 0.800843 0.891527 H\n0.799209 0.749811 0.929371 H\n0.541034 0.915264 0.754094 H\n0.976986 0.893992 0.790031 H\n0.716580 0.091836 0.619142 H\n0.156626 0.084777 0.654706 H\n0.073417 0.556218 0.355286 H\n0.334045 0.306109 0.521991 H\n0.008817 0.935783 0.161144 Pb\n0.295231 0.566344 0.039167 C\n0.396355 0.431511 0.959194 C\n0.553125 0.642594 0.899115 C\n0.619433 0.535956 0.811368 C\n0.742886 0.775745 0.757126 C\n0.825940 0.705421 0.667239 C\n0.206767 0.159247 0.393279 C\n0.021383 0.916957 0.528489 C\n0.112659 0.185449 0.484859 C\n0.299690 0.440983 0.358235 C\n0.456372 0.459761 0.272931 C\n0.930753 -0.036227 0.619306 C\n0.072650 0.442373 0.084620 O\n0.507939 0.700215 0.244611 O\n0.536795 0.249096 0.236197 O\n0.430496 0.815528 0.056695 O\n","nsites":37,"nelements":4,"elements":["H","Pb","C","O"],"chemical_system":"C-H-O-Pb","density":2.403712860580186,"density_atomic":0.12298785085666059,"volume":300.84272342576844,"volume_molar":4.8965330461938565,"formula_full":"H20 Pb1 C12 O4","formula_reduced":"H20Pb(C3O)4","formula_anonymous":"AB4C12D20","energy_above_hull":4.670724454594596,"spacegroup":1},{"id":"jvasp-98291","created_at":"2022-09-04T14:35:48.970159Z","updated_at":"2022-09-04T14:35:48.970185Z","structure_string":"H16 Pb4 C8 O24\n1.0\n7.744282 -0.000009 -0.000010\n-0.000010 7.622388 -0.000003\n-0.000011 -0.000003 9.373292\nH Pb C O\n16 4 8 24\ndirect\n0.851883 0.038308 0.166782 H\n0.150488 0.664313 0.603131 H\n0.349512 0.835688 0.103132 H\n0.849513 0.335689 0.396869 H\n0.148116 0.961692 0.833218 H\n0.650488 0.164311 0.896868 H\n0.648117 0.461691 0.666782 H\n0.150487 0.835688 0.103132 H\n0.849513 0.164312 0.896868 H\n0.148117 0.538310 0.333218 H\n0.351883 0.538310 0.333218 H\n0.349513 0.664313 0.603131 H\n0.851883 0.461691 0.666782 H\n0.648117 0.038308 0.166781 H\n0.650488 0.335689 0.396869 H\n0.351883 0.961692 0.833218 H\n0.750000 0.455591 0.095889 Pb\n0.250000 0.544410 0.904111 Pb\n0.249999 0.955591 0.404112 Pb\n0.750000 0.044410 0.595888 Pb\n0.649312 0.722842 0.369064 C\n0.350688 0.277159 0.630935 C\n0.850688 0.722843 0.369065 C\n0.850687 0.777160 0.869066 C\n0.149312 0.222840 0.130934 C\n0.350689 0.222842 0.130936 C\n0.149312 0.277158 0.630935 C\n0.649311 0.777158 0.869063 C\n0.426997 0.111320 0.208586 O\n0.426996 0.388679 0.708586 O\n0.750000 -0.015549 0.121201 O\n0.926421 0.666333 0.948751 O\n0.573578 0.666335 0.948753 O\n0.926998 0.611322 0.291412 O\n0.750000 0.232848 0.863914 O\n0.426421 0.333666 0.051247 O\n0.573002 0.888680 0.791414 O\n0.926996 0.888679 0.791413 O\n0.573580 0.833666 0.448752 O\n0.250000 0.015548 0.878799 O\n0.073579 0.333668 0.051248 O\n0.750000 0.515548 0.621201 O\n0.250000 0.484454 0.378800 O\n0.573004 0.611322 0.291414 O\n0.250000 0.732849 0.636086 O\n0.073003 0.388679 0.708587 O\n0.750000 0.267153 0.363914 O\n0.250000 0.767152 0.136086 O\n0.073578 0.166333 0.551247 O\n0.926422 0.833667 0.448753 O\n0.073004 0.111321 0.208588 O\n0.426421 0.166335 0.551247 O\n","nsites":52,"nelements":4,"elements":["H","Pb","C","O"],"chemical_system":"C-H-O-Pb","density":3.9764913457574362,"density_atomic":0.09398076728118003,"volume":553.3046973794305,"volume_molar":6.407843789977181,"formula_full":"H16 Pb4 C8 O24","formula_reduced":"H4Pb(CO3)2","formula_anonymous":"AB2C4D6","energy_above_hull":3.4155886015384613,"spacegroup":62},{"id":"jvasp-101979","created_at":"2022-09-04T14:36:57.936809Z","updated_at":"2022-09-04T14:36:57.936840Z","structure_string":"H16 Pb1 C10 O4\n1.0\n3.881337 0.020448 0.202307\n0.700357 4.328850 0.414202\n0.182080 0.020700 15.095580\nH Pb C O\n16 1 10 4\ndirect\n0.932073 0.832692 0.584893 H\n0.576216 0.323011 0.566417 H\n0.269900 0.247726 0.077159 H\n0.843760 0.321668 0.041402 H\n0.057936 0.281183 0.239135 H\n0.631843 0.327444 0.201519 H\n0.824247 0.298931 0.401610 H\n0.402877 0.321499 0.362544 H\n0.627505 0.809212 0.469071 H\n0.168349 0.311974 0.523598 H\n0.165199 0.761951 0.146243 H\n0.731619 0.826135 0.111537 H\n0.899085 0.789839 0.309167 H\n0.472233 0.826381 0.272566 H\n0.338087 0.824786 0.630928 H\n0.207079 0.820851 0.431131 H\n0.676408 0.129178 0.835262 Pb\n0.195263 0.594097 0.970663 C\n0.058702 0.437691 0.056770 C\n0.948765 0.644220 0.132663 C\n0.835617 0.457688 0.217221 C\n0.699308 0.654738 0.294027 C\n0.341708 0.470711 0.539528 C\n0.440694 0.660899 0.454199 C\n0.161735 0.675908 0.610742 C\n0.043843 0.503447 0.695658 C\n0.594232 0.463905 0.378600 C\n0.152474 0.479031 0.896798 O\n0.771248 0.624870 0.739462 O\n0.212405 0.234592 0.721012 O\n0.352090 0.821539 0.972655 O\n","nsites":31,"nelements":4,"elements":["H","Pb","C","O"],"chemical_system":"C-H-O-Pb","density":2.6717341305999733,"density_atomic":0.12241963569967555,"volume":253.2273505212053,"volume_molar":4.919260481034057,"formula_full":"H16 Pb1 C10 O4","formula_reduced":"H16Pb(C5O2)2","formula_anonymous":"AB4C10D16","energy_above_hull":4.614577574838711,"spacegroup":1},{"id":"jvasp-104017","created_at":"2022-09-04T14:37:16.012368Z","updated_at":"2022-09-04T14:37:16.012386Z","structure_string":"H12 Pb1 C8 O4\n1.0\n3.973777 -0.075285 -0.191299\n-0.907342 4.236377 -0.083682\n-0.186372 0.042976 12.961316\nH Pb C O\n12 1 8 4\ndirect\n0.498668 0.236453 0.542486 H\n0.062634 0.143524 0.574849 H\n0.033088 0.161987 0.160957 H\n0.604612 0.093873 0.198632 H\n0.408442 0.717720 0.450868 H\n0.260902 0.194501 0.351189 H\n0.178744 0.684750 0.259778 H\n0.752395 0.617107 0.298290 H\n0.950532 0.667888 0.074594 H\n0.514580 0.575240 0.107022 H\n-0.020076 0.649448 0.488509 H\n0.834514 0.126741 0.389674 H\n0.006533 0.905760 0.824752 Pb\n0.385573 0.542420 0.657712 C\n0.279737 0.340263 0.559847 C\n0.183287 0.529374 0.467629 C\n0.057710 0.316138 0.371419 C\n0.955519 0.495403 0.278048 C\n0.829810 0.282148 0.181851 C\n0.733365 0.471265 0.089633 C\n0.627204 0.269076 0.991786 C\n0.234098 0.452420 0.741150 O\n0.615710 0.798404 0.655784 O\n0.778331 0.359028 0.908287 O\n0.397079 0.013107 -0.006219 O\n","nsites":25,"nelements":4,"elements":["H","Pb","C","O"],"chemical_system":"C-H-O-Pb","density":2.9006894237234824,"density_atomic":0.11511169542842009,"volume":217.18036474882564,"volume_molar":5.231562907302281,"formula_full":"H12 Pb1 C8 O4","formula_reduced":"H12Pb(C2O)4","formula_anonymous":"AB4C8D12","energy_above_hull":4.5312781928,"spacegroup":2},{"id":"jvasp-101977","created_at":"2022-09-04T14:37:51.074103Z","updated_at":"2022-09-04T14:37:51.074120Z","structure_string":"H12 Pb1 C8 O4\n1.0\n3.977387 -0.073103 -0.193621\n-0.907975 4.232406 -0.080124\n-0.199501 0.042410 12.963957\nH Pb C O\n12 1 8 4\ndirect\n0.492461 0.221651 0.544822 H\n0.056109 0.129802 0.577075 H\n0.028759 0.148230 0.163149 H\n0.599813 0.080143 0.200528 H\n0.403367 0.705009 0.453029 H\n0.256245 0.180788 0.353365 H\n0.173917 0.672430 0.261871 H\n0.747195 0.604318 0.300194 H\n0.947298 0.655253 0.076474 H\n0.510986 0.563634 0.108758 H\n0.974394 0.636731 0.490386 H\n0.829489 0.112573 0.391663 H\n0.001636 0.892598 0.826785 Pb\n0.380417 0.528910 0.659790 C\n0.273819 0.326969 0.562037 C\n0.177921 0.515795 0.469693 C\n0.052775 0.303018 0.373485 C\n0.950604 0.482030 0.280062 C\n0.825331 0.269273 0.183857 C\n0.729510 0.458177 0.091523 C\n0.622712 0.256295 0.993769 C\n0.229462 0.439423 0.743080 O\n0.611096 0.784032 0.657892 O\n0.773438 0.345824 0.910446 O\n0.392057 0.001160 -0.004308 O\n","nsites":25,"nelements":4,"elements":["H","Pb","C","O"],"chemical_system":"C-H-O-Pb","density":2.9000267155858284,"density_atomic":0.1150853963504576,"volume":217.22999435888545,"volume_molar":5.232758413292856,"formula_full":"H12 Pb1 C8 O4","formula_reduced":"H12Pb(C2O)4","formula_anonymous":"AB4C8D12","energy_above_hull":4.5315569928,"spacegroup":2}]}