{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_full&page=66","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_full&page=64","results":[{"id":"jvasp-18389","created_at":"2022-09-04T14:38:03.413591Z","updated_at":"2022-09-04T14:38:03.413619Z","structure_string":"Zr1 H2\n1.0\n2.953260 -0.000000 1.705065\n0.984420 2.784360 1.705065\n-0.000000 -0.000000 3.410131\nZr H\n1 2\ndirect\n0.000000 0.000000 0.000000 Zr\n0.750000 0.750000 0.749998 H\n0.250000 0.250000 0.249999 H\n","nsites":3,"nelements":2,"elements":["Zr","H"],"chemical_system":"H-Zr","density":5.521443994883847,"density_atomic":0.10698505708224222,"volume":28.041299241386778,"volume_molar":5.6289550374970805,"formula_full":"Zr1 H2","formula_reduced":"ZrH2","formula_anonymous":"AB2","energy_above_hull":2.6024781666666668,"spacegroup":225},{"id":"jvasp-112153","created_at":"2022-09-04T14:38:45.629284Z","updated_at":"2022-09-04T14:38:45.629336Z","structure_string":"Zr1 H12 C8 O4\n1.0\n4.120665 0.005645 0.006551\n1.398685 4.024497 -0.124557\n0.075067 -0.107080 11.690188\nZr H C O\n1 12 8 4\ndirect\n0.818113 0.539008 0.872724 Zr\n0.899883 0.100509 0.411309 H\n0.179949 0.258565 0.567459 H\n0.417360 0.834359 0.591480 H\n0.168923 0.431647 0.359900 H\n0.490812 0.475068 0.449660 H\n0.814919 0.793531 0.489620 H\n0.690643 0.519156 0.264634 H\n0.695544 0.685044 0.084673 H\n0.462952 0.110895 0.090808 H\n0.990636 0.004070 0.198211 H\n0.154774 0.575071 0.160005 H\n0.529011 0.937679 0.312932 H\n0.430581 0.866261 0.080459 C\n0.230091 0.794251 0.181987 C\n0.451186 0.721543 0.288954 C\n0.288297 0.612307 0.392103 C\n0.310993 0.831033 0.959117 C\n0.161703 0.009846 0.574413 C\n0.943659 0.006309 0.678571 C\n0.020774 0.888010 0.464360 C\n0.312737 0.496085 0.936779 O\n0.717540 0.270974 0.720120 O\n0.991046 0.723466 0.720180 O\n0.974624 0.040715 0.934030 O\n","nsites":25,"nelements":4,"elements":["Zr","H","C","O"],"chemical_system":"C-H-O-Zr","density":2.2579031820157462,"density_atomic":0.1290554552604222,"volume":193.71517422144046,"volume_molar":4.666320186037752,"formula_full":"Zr1 H12 C8 O4","formula_reduced":"ZrH12(C2O)4","formula_anonymous":"AB4C8D12","energy_above_hull":4.735713939999999,"spacegroup":1},{"id":"jvasp-103949","created_at":"2022-09-04T14:36:56.332562Z","updated_at":"2022-09-04T14:36:56.332586Z","structure_string":"Zr1 H12 C8 O4\n1.0\n4.074109 0.004085 0.612120\n1.296259 3.951802 0.263144\n0.013702 0.097891 11.968488\nZr H C O\n1 12 8 4\ndirect\n0.985744 0.595059 0.876199 Zr\n0.832921 0.099548 0.396110 H\n0.794924 0.300529 0.576562 H\n0.244836 0.090493 0.548160 H\n0.138572 0.416227 0.373255 H\n0.408004 0.496992 0.460074 H\n0.708139 0.795048 0.484213 H\n0.683472 0.531116 0.274495 H\n0.762595 0.682402 0.091516 H\n0.534096 0.116118 0.093147 H\n0.013219 0.994517 0.194286 H\n0.198627 0.557116 0.168314 H\n0.491985 0.958375 0.308718 H\n0.503456 0.867597 0.083678 C\n0.259556 0.787000 0.184440 C\n0.431665 0.728898 0.292384 C\n0.231241 0.616354 0.398273 C\n0.452119 0.845535 0.962203 C\n0.990639 0.052925 0.561269 C\n0.963998 0.853155 0.669744 C\n0.924629 0.894233 0.457526 C\n0.482908 0.508420 0.933821 O\n0.710088 0.964983 0.747027 O\n0.195572 0.571449 0.691833 O\n0.131797 0.048459 0.926250 O\n","nsites":25,"nelements":4,"elements":["Zr","H","C","O"],"chemical_system":"C-H-O-Zr","density":2.271333531691284,"density_atomic":0.1298230966302952,"volume":192.5697402766008,"volume_molar":4.638728328249326,"formula_full":"Zr1 H12 C8 O4","formula_reduced":"ZrH12(C2O)4","formula_anonymous":"AB4C8D12","energy_above_hull":4.73568314,"spacegroup":1},{"id":"jvasp-103948","created_at":"2022-09-04T14:36:55.987947Z","updated_at":"2022-09-04T14:36:55.987965Z","structure_string":"Zr1 H10 C7 O4\n1.0\n4.535444 0.119088 -0.354564\n1.704864 4.663976 0.107826\n-1.068404 0.242907 9.141648\nZr H C O\n1 10 7 4\ndirect\n0.673062 0.168122 0.808054 Zr\n-0.289670 0.911592 0.338139 H\n0.169803 0.766454 0.525147 H\n0.241710 0.395157 0.504729 H\n0.619579 0.561385 0.164726 H\n0.553182 0.689248 0.419876 H\n0.088161 0.684332 0.149987 H\n0.326020 0.429603 0.298339 H\n0.333228 0.789375 0.857142 H\n0.523925 0.170173 0.114171 H\n0.860286 0.265006 0.298699 H\n-0.028789 0.574523 0.667012 C\n0.054634 0.605841 0.516331 C\n0.127102 0.121593 -0.012382 C\n0.768379 0.687955 0.382509 C\n0.829929 0.484487 0.257067 C\n0.128891 0.467836 0.201467 C\n0.259846 0.242653 0.098666 C\n0.877773 0.340123 0.678381 O\n0.261304 0.523546 0.780047 O\n0.729247 0.826910 0.694193 O\n0.384075 0.948365 0.912190 O\n","nsites":22,"nelements":4,"elements":["Zr","H","C","O"],"chemical_system":"C-H-O-Zr","density":2.1855277143519136,"density_atomic":0.11611154958263659,"volume":189.4729687018999,"volume_molar":5.186513126081436,"formula_full":"Zr1 H10 C7 O4","formula_reduced":"ZrH10C7O4","formula_anonymous":"AB4C7D10","energy_above_hull":4.704912204545455,"spacegroup":1},{"id":"jvasp-112152","created_at":"2022-09-04T14:38:45.299786Z","updated_at":"2022-09-04T14:38:45.299803Z","structure_string":"Zr1 H10 C7 O4\n1.0\n3.931967 -0.104727 -0.174215\n-1.356759 4.311723 -0.671318\n0.133733 -0.164112 10.703408\nZr H C O\n1 10 7 4\ndirect\n0.883135 0.185390 0.248762 Zr\n0.197181 0.744071 0.652673 H\n0.527484 0.045580 0.516640 H\n0.276873 0.306928 0.536408 H\n0.746486 0.941669 0.778367 H\n0.793201 0.709523 0.569299 H\n0.374288 0.137063 0.870016 H\n0.477435 0.446934 0.783556 H\n0.876830 0.342502 0.961397 H\n0.084538 0.692011 0.901209 H\n0.826928 0.245698 0.690012 H\n0.082789 0.921945 0.379716 C\n0.252142 0.056584 0.515869 C\n0.388724 0.604048 0.052247 C\n0.045540 0.882717 0.616504 C\n0.952162 0.091952 0.728305 C\n0.260224 0.292242 0.827574 C\n0.130182 0.491882 0.934316 C\n0.348444 0.427611 0.135575 O\n0.331826 0.045408 0.290799 O\n0.981809 0.595960 0.354511 O\n0.648232 0.864355 0.064848 O\n","nsites":22,"nelements":4,"elements":["Zr","H","C","O"],"chemical_system":"C-H-O-Zr","density":2.3059551977198334,"density_atomic":0.12250955662430561,"volume":179.57782728302888,"volume_molar":4.9156497876062195,"formula_full":"Zr1 H10 C7 O4","formula_reduced":"ZrH10C7O4","formula_anonymous":"AB4C7D10","energy_above_hull":4.701156295454545,"spacegroup":1},{"id":"jvasp-51342","created_at":"2022-09-04T14:37:06.157373Z","updated_at":"2022-09-04T14:37:06.157400Z","structure_string":"Zr1 H1\n1.0\n-1.649852 1.649852 2.476712\n1.649852 -1.649852 2.476712\n1.649852 1.649852 -2.476712\nZr H\n1 1\ndirect\n0.000000 0.000000 0.000000 Zr\n0.749999 0.250000 0.499999 H\n","nsites":2,"nelements":2,"elements":["Zr","H"],"chemical_system":"H-Zr","density":5.679432813330847,"density_atomic":0.07416594262391263,"volume":26.9665553924364,"volume_molar":8.119819619279452,"formula_full":"Zr1 H1","formula_reduced":"ZrH","formula_anonymous":"AB","energy_above_hull":2.1237622499999995,"spacegroup":119},{"id":"jvasp-38834","created_at":"2022-09-04T14:37:54.516285Z","updated_at":"2022-09-04T14:37:54.516314Z","structure_string":"Zr1 Ge1 Ru2\n1.0\n-0.000000 3.145876 3.145876\n3.145876 -0.000000 3.145876\n3.145876 3.145876 -0.000000\nZr Ge Ru\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Zr\n0.249999 0.249999 0.249999 Ge\n0.000000 0.000000 0.000000 Ru\n0.500001 0.500001 0.500001 Ru\n","nsites":4,"nelements":3,"elements":["Zr","Ge","Ru"],"chemical_system":"Ge-Ru-Zr","density":9.760681307884749,"density_atomic":0.06423995013157892,"volume":62.26654895912955,"volume_molar":9.374448061782742,"formula_full":"Zr1 Ge1 Ru2","formula_reduced":"ZrGeRu2","formula_anonymous":"ABC2","energy_above_hull":3.376540362500001,"spacegroup":225},{"id":"jvasp-40796","created_at":"2022-09-04T14:37:56.919842Z","updated_at":"2022-09-04T14:37:56.919860Z","structure_string":"Zr1 Ge1 Pt1\n1.0\n3.881097 0.000000 2.240752\n1.293699 3.659134 2.240752\n0.000000 -0.000000 4.481505\nZr Ge Pt\n1 1 1\ndirect\n0.250000 0.250000 0.249999 Zr\n0.000000 0.000000 0.000000 Ge\n0.500001 0.499999 0.499999 Pt\n","nsites":3,"nelements":3,"elements":["Zr","Ge","Pt"],"chemical_system":"Ge-Pt-Zr","density":9.365348415689049,"density_atomic":0.04713728432409115,"volume":63.64388706344599,"volume_molar":12.775748213653827,"formula_full":"Zr1 Ge1 Pt1","formula_reduced":"ZrGePt","formula_anonymous":"ABC","energy_above_hull":2.14585395,"spacegroup":216},{"id":"jvasp-111612","created_at":"2022-09-04T14:38:26.571328Z","updated_at":"2022-09-04T14:38:26.571354Z","structure_string":"Zr1 Ga6 Fe6\n1.0\n6.395685 -0.005828 -1.078591\n-1.603542 4.307904 -4.575891\n-0.015245 0.005828 6.485977\nZr Ga Fe\n1 6 6\ndirect\n0.000000 0.000000 0.000000 Zr\n0.330488 -0.000000 0.330489 Ga\n0.669511 -0.000000 0.669512 Ga\n0.659430 0.659430 -0.000001 Ga\n0.340569 0.340569 -0.000000 Ga\n0.175100 0.675100 0.500000 Ga\n0.824899 0.324899 0.500000 Ga\n0.755508 0.499999 0.255509 Fe\n0.244490 0.500000 0.744491 Fe\n-0.000000 0.000000 0.500000 Fe\n0.000000 0.500000 -0.000000 Fe\n0.500000 -0.000000 -0.000000 Fe\n0.499999 0.500000 0.500000 Fe\n","nsites":13,"nelements":3,"elements":["Zr","Ga","Fe"],"chemical_system":"Fe-Ga-Zr","density":7.846384668030309,"density_atomic":0.072727108169721,"volume":178.75040445252273,"volume_molar":8.280462280923253,"formula_full":"Zr1 Ga6 Fe6","formula_reduced":"Zr(GaFe)6","formula_anonymous":"AB6C6","energy_above_hull":2.0839385730769227,"spacegroup":71},{"id":"jvasp-35510","created_at":"2022-09-04T14:37:40.214261Z","updated_at":"2022-09-04T14:37:40.214282Z","structure_string":"Zr1 Ga5 Co1\n1.0\n4.135815 0.000000 0.000000\n0.000000 4.135815 0.000000\n0.000000 0.000000 6.672389\nZr Ga Co\n1 5 1\ndirect\n0.000000 0.000000 0.000000 Zr\n0.000000 0.500001 0.305071 Ga\n0.000000 0.500001 0.694929 Ga\n0.500001 0.000000 0.305071 Ga\n0.500001 0.000000 0.694929 Ga\n0.500001 0.500001 0.000000 Ga\n0.000000 0.000000 0.500000 Co\n","nsites":7,"nelements":3,"elements":["Zr","Ga","Co"],"chemical_system":"Co-Ga-Zr","density":7.256843657073135,"density_atomic":0.06133303760831532,"volume":114.13098507697202,"volume_molar":9.818755103014071,"formula_full":"Zr1 Ga5 Co1","formula_reduced":"ZrGa5Co","formula_anonymous":"ABC5","energy_above_hull":0.8240895749999997,"spacegroup":123},{"id":"jvasp-18714","created_at":"2022-09-04T14:36:35.071089Z","updated_at":"2022-09-04T14:36:35.071116Z","structure_string":"Zr1 Ga3\n1.0\n3.613297 0.000000 -1.496215\n-0.619561 3.559784 -1.496215\n0.105887 0.125908 5.366801\nZr Ga\n1 3\ndirect\n0.000000 0.000000 0.000000 Zr\n0.750001 0.250000 0.500001 Ga\n0.500000 0.499999 0.000001 Ga\n0.250001 0.749999 0.500001 Ga\n","nsites":4,"nelements":2,"elements":["Zr","Ga"],"chemical_system":"Ga-Zr","density":7.0862189744031365,"density_atomic":0.05682450407937046,"volume":70.3921673370513,"volume_molar":10.597788502629934,"formula_full":"Zr1 Ga3","formula_reduced":"ZrGa3","formula_anonymous":"AB3","energy_above_hull":0.63460286875,"spacegroup":139},{"id":"jvasp-101628","created_at":"2022-09-04T14:37:15.943012Z","updated_at":"2022-09-04T14:37:15.943035Z","structure_string":"Zr1 Ga1 Ru2\n1.0\n3.856354 0.000000 2.226467\n1.285451 3.635806 2.226467\n-0.000000 0.000000 4.452934\nZr Ga Ru\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Zr\n0.499999 0.500001 0.500000 Ga\n0.250000 0.250000 0.250000 Ru\n0.749999 0.750001 0.750000 Ru\n","nsites":4,"nelements":3,"elements":["Zr","Ga","Ru"],"chemical_system":"Ga-Ru-Zr","density":9.656860174626923,"density_atomic":0.06406725803054213,"volume":62.43438728239502,"volume_molar":9.399716711973417,"formula_full":"Zr1 Ga1 Ru2","formula_reduced":"ZrGaRu2","formula_anonymous":"ABC2","energy_above_hull":3.07491695625,"spacegroup":225}]}