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{
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{
"id": "jvasp-16437",
"created_at": "2022-09-04T14:38:14.801250Z",
"updated_at": "2022-09-04T14:38:14.801271Z",
"structure_string": "Mg1 Zn1 Ag2\n1.0\n3.960595 -0.000000 2.286651\n1.320198 3.734084 2.286651\n-0.000000 -0.000000 4.573301\nMg Zn Ag\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.499999 0.500000 Zn\n0.750000 0.749999 0.750000 Ag\n0.250000 0.250000 0.250000 Ag\n",
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"density": 7.499209584221766,
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"volume": 67.63543763008896,
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{
"id": "jvasp-123342",
"created_at": "2022-09-04T14:38:53.105406Z",
"updated_at": "2022-09-04T14:38:53.105422Z",
"structure_string": "Mn1 Ag3\n1.0\n4.093175 -0.000000 0.000000\n0.000000 4.093175 -0.000000\n0.000000 0.000000 4.093175\nMn Ag\n1 3\ndirect\n0.000000 0.000000 0.000000 Mn\n0.000000 0.500001 0.500001 Ag\n0.500001 0.000000 0.500001 Ag\n0.500001 0.500001 0.000000 Ag\n",
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"formula_full": "Mn1 Ag3",
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},
{
"id": "jvasp-16295",
"created_at": "2022-09-04T14:37:56.940994Z",
"updated_at": "2022-09-04T14:37:56.941022Z",
"structure_string": "Mn3 Ag1 N1\n1.0\n3.976293 -0.000000 -0.000000\n0.000000 3.976293 -0.000000\n-0.000000 0.000000 3.976293\nMn Ag N\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Mn\n0.500000 0.500000 0.000000 Mn\n0.500000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 N\n",
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"elements": [
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"Ag",
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],
"chemical_system": "Ag-Mn-N",
"density": 7.572251751449823,
"density_atomic": 0.07953071161780943,
"volume": 62.86879493833603,
"volume_molar": 7.5720946506047015,
"formula_full": "Mn3 Ag1 N1",
"formula_reduced": "Mn3AgN",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.738840446827585,
"spacegroup": 221
},
{
"id": "jvasp-43501",
"created_at": "2022-09-04T14:37:16.412367Z",
"updated_at": "2022-09-04T14:37:16.412403Z",
"structure_string": "Mn2 Ag2 O6\n1.0\n5.020810 0.000111 0.000426\n2.510267 4.348477 0.000212\n2.508986 1.450793 5.199142\nMn Ag O\n2 2 6\ndirect\n0.660202 0.660210 0.019395 Mn\n0.339800 0.339790 0.980605 Mn\n0.861992 0.861838 0.414208 Ag\n0.138010 0.138162 0.585792 Ag\n0.939319 0.314815 0.203321 O\n0.457361 0.060804 0.796700 O\n0.685061 0.457490 0.796701 O\n0.314940 0.542509 0.203299 O\n0.542640 0.939196 0.203300 O\n0.060683 0.685184 0.796679 O\n",
"nsites": 10,
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"elements": [
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"Ag",
"O"
],
"chemical_system": "Ag-Mn-O",
"density": 6.1679310704039905,
"density_atomic": 0.08810096275907875,
"volume": 113.50613758156129,
"volume_molar": 6.835499376400881,
"formula_full": "Mn2 Ag2 O6",
"formula_reduced": "MnAgO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.148633000275862,
"spacegroup": 148
},
{
"id": "jvasp-99627",
"created_at": "2022-09-04T14:36:32.899628Z",
"updated_at": "2022-09-04T14:36:32.899654Z",
"structure_string": "Mn2 Ag2 O6\n1.0\n4.346145 -0.000639 2.509707\n-1.446769 5.199398 -2.509947\n-0.000616 -0.000508 5.019143\nMn Ag O\n2 2 6\ndirect\n0.339824 0.019415 0.339768 Mn\n0.660175 0.980584 0.660232 Mn\n0.138080 0.414419 0.138202 Ag\n0.861919 0.585581 0.861798 Ag\n0.060681 0.203381 0.457498 O\n0.542642 0.796620 0.314708 O\n0.314840 0.796622 0.939179 O\n0.685160 0.203378 0.060821 O\n0.457357 0.203380 0.685292 O\n0.939319 0.796619 0.542502 O\n",
"nsites": 10,
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"elements": [
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],
"chemical_system": "Ag-Mn-O",
"density": 6.172671459909554,
"density_atomic": 0.08816867312654655,
"volume": 113.4189689533744,
"volume_molar": 6.830249958912905,
"formula_full": "Mn2 Ag2 O6",
"formula_reduced": "MnAgO3",
"formula_anonymous": "ABC3",
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"spacegroup": 148
},
{
"id": "jvasp-119598",
"created_at": "2022-09-04T14:38:52.451780Z",
"updated_at": "2022-09-04T14:38:52.451817Z",
"structure_string": "Mn4 Ag4 O16\n1.0\n5.892671 0.000000 0.000000\n0.000000 7.421997 0.000000\n-0.000000 0.000000 7.216682\nMn Ag O\n4 4 16\ndirect\n0.750000 0.165549 0.500025 Mn\n0.250000 0.665549 0.999975 Mn\n0.250000 0.834452 0.499975 Mn\n0.750000 0.334451 0.000025 Mn\n0.750000 0.750004 0.249970 Ag\n0.250000 0.250004 0.250030 Ag\n0.250000 0.249996 0.750030 Ag\n0.750000 0.749996 0.749970 Ag\n0.484310 0.785933 0.999989 O\n0.984310 0.285932 0.500010 O\n0.984310 0.214068 0.000010 O\n0.484310 0.714068 0.499990 O\n0.015690 0.785933 0.999989 O\n0.515690 0.285932 0.500010 O\n0.750000 0.462968 0.816087 O\n0.750000 0.462951 0.183977 O\n0.250000 0.537032 0.183913 O\n0.750000 0.037032 0.316087 O\n0.015690 0.714068 0.499990 O\n0.250000 -0.037049 0.316023 O\n0.250000 0.537050 0.816023 O\n0.750000 0.037049 0.683977 O\n0.250000 0.962968 0.683913 O\n0.515690 0.214068 0.000010 O\n",
"nsites": 24,
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"elements": [
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],
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"density": 4.772972852994964,
"density_atomic": 0.07603975419639188,
"volume": 315.6243764020322,
"volume_molar": 7.919726758251086,
"formula_full": "Mn4 Ag4 O16",
"formula_reduced": "MnAgO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.335401416896552,
"spacegroup": 74
},
{
"id": "jvasp-36782",
"created_at": "2022-09-04T14:35:47.999528Z",
"updated_at": "2022-09-04T14:35:47.999549Z",
"structure_string": "Mn1 Ag1 O2\n1.0\n1.197705 2.293597 1.353215\n0.005014 -0.013076 -3.132653\n-5.831732 2.332909 1.207453\nMn Ag O\n1 1 2\ndirect\n0.500001 0.000002 0.500000 Mn\n0.000000 0.000000 0.000000 Ag\n0.101062 0.202125 0.336220 O\n0.898938 0.797877 0.663780 O\n",
"nsites": 4,
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"elements": [
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],
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"density": 6.401243061747292,
"density_atomic": 0.07915439103774205,
"volume": 50.53415164412973,
"volume_molar": 7.608094359703366,
"formula_full": "Mn1 Ag1 O2",
"formula_reduced": "MnAgO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8875303753448271,
"spacegroup": 12
},
{
"id": "jvasp-36850",
"created_at": "2022-09-04T14:35:48.244342Z",
"updated_at": "2022-09-04T14:35:48.244360Z",
"structure_string": "Mn1 Ag1 O2\n1.0\n-2.957793 -0.000000 0.726040\n-1.568006 2.610944 -0.000000\n-2.978103 -0.012198 -5.744544\nMn Ag O\n1 1 2\ndirect\n0.500001 0.499999 0.500000 Mn\n0.000000 0.000000 0.000000 Ag\n0.886900 0.886898 0.339302 O\n0.113101 0.113100 0.660697 O\n",
"nsites": 4,
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],
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"density": 6.46674027455094,
"density_atomic": 0.07996429498048141,
"volume": 50.02232560139954,
"volume_molar": 7.531037147854492,
"formula_full": "Mn1 Ag1 O2",
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"formula_anonymous": "ABC2",
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"spacegroup": 166
},
{
"id": "jvasp-36852",
"created_at": "2022-09-04T14:35:51.259232Z",
"updated_at": "2022-09-04T14:35:51.259258Z",
"structure_string": "Mn2 Ag2 O4\n1.0\n1.522253 -2.636619 -0.000000\n1.522253 2.636619 -0.000000\n0.000000 0.000000 12.458741\nMn Ag O\n2 2 4\ndirect\n0.000000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.666666 0.333332 0.750000 Ag\n0.333332 0.666666 0.250000 Ag\n0.666666 0.333332 0.919653 O\n0.333332 0.666666 0.080347 O\n0.333332 0.666666 0.419653 O\n0.666666 0.333332 0.580347 O\n",
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"formula_full": "Mn2 Ag2 O4",
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"formula_anonymous": "ABC2",
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"spacegroup": 194
},
{
"id": "jvasp-57136",
"created_at": "2022-09-04T14:38:31.622805Z",
"updated_at": "2022-09-04T14:38:31.622829Z",
"structure_string": "Sr2 Mn2 V4 Ag4 O16\n1.0\n5.619218 0.000000 0.000000\n-2.809610 4.970373 -0.056872\n0.000000 -0.065874 13.661851\nSr Mn V Ag O\n2 2 4 4 16\ndirect\n0.918746 0.000000 0.250000 Sr\n0.081255 0.000001 0.750000 Sr\n0.000000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.634502 0.350587 0.372086 V\n0.365498 0.649413 0.627914 V\n0.716085 0.350587 0.872086 V\n0.283915 0.649413 0.127914 V\n0.290579 0.686143 0.400976 Ag\n0.709422 0.313857 0.599024 Ag\n0.604436 0.313856 0.099024 Ag\n0.395564 0.686144 0.900976 Ag\n0.079199 0.307387 0.098558 O\n0.278163 0.177349 0.385227 O\n0.100813 0.822650 0.114773 O\n0.228189 0.307388 0.598558 O\n0.920801 0.692613 0.901442 O\n0.771812 0.692613 0.401442 O\n0.280731 0.680817 0.746745 O\n0.575509 0.789198 0.053413 O\n0.719269 0.319183 0.253255 O\n0.400085 0.680816 0.246745 O\n0.424491 0.210802 0.946587 O\n0.213689 0.789198 0.553413 O\n0.899187 0.177350 0.885227 O\n0.786311 0.210802 0.446588 O\n0.599915 0.319184 0.753255 O\n0.721838 0.822651 0.614773 O\n",
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],
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"density_atomic": 0.0733850485089109,
"volume": 381.5491107374557,
"volume_molar": 8.20622304183495,
"formula_full": "Sr2 Mn2 V4 Ag4 O16",
"formula_reduced": "SrMnV2(AgO4)2",
"formula_anonymous": "ABC2D2E8",
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"spacegroup": 15
},
{
"id": "jvasp-57445",
"created_at": "2022-09-04T14:38:32.065194Z",
"updated_at": "2022-09-04T14:38:32.065223Z",
"structure_string": "Mn4 V4 Ag4 O16\n1.0\n5.377234 0.000000 0.000000\n-0.000000 6.757470 0.000000\n0.000000 0.000000 9.572377\nMn V Ag O\n4 4 4 16\ndirect\n0.500000 0.500000 0.500000 Mn\n0.000000 0.500000 0.000000 Mn\n0.500000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.978199 0.750000 0.678105 V\n0.478200 0.250000 0.821895 V\n0.021800 0.250000 0.321895 V\n0.521799 0.750000 0.178105 V\n0.503102 0.750000 0.847254 Ag\n0.003102 0.250000 0.652747 Ag\n0.496898 0.250000 0.152747 Ag\n0.996897 0.750000 0.347254 Ag\n0.684848 0.548338 0.113517 O\n0.184848 0.451662 0.386483 O\n0.684848 0.951662 0.113517 O\n0.184848 0.048338 0.386483 O\n0.315152 0.451662 0.886483 O\n0.815151 0.548338 0.613517 O\n0.211394 0.750000 0.116691 O\n0.437437 0.250000 0.635188 O\n0.788605 0.250000 0.883309 O\n0.288606 0.750000 0.616691 O\n0.562562 0.750000 0.364813 O\n0.062563 0.250000 0.135188 O\n0.815151 0.951662 0.613517 O\n0.937436 0.750000 0.864813 O\n0.711394 0.250000 0.383309 O\n0.315152 0.048338 0.886483 O\n",
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],
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"density": 5.303871832034662,
"density_atomic": 0.08049986915022779,
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"formula_full": "Mn4 V4 Ag4 O16",
"formula_reduced": "MnVAgO4",
"formula_anonymous": "ABCD4",
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"spacegroup": 62
},
{
"id": "jvasp-76797",
"created_at": "2022-09-04T14:37:11.231635Z",
"updated_at": "2022-09-04T14:37:11.231650Z",
"structure_string": "Mn1 Ag1 Pd2\n1.0\n-10.600967 2.757064 -1.618203\n-7.341974 0.799465 1.170196\n-6.157377 4.150011 -0.881587\nMn Ag Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mn\n0.500000 0.000001 -0.000001 Ag\n0.749940 0.000042 0.000040 Pd\n0.250060 -0.000040 -0.000041 Pd\n",
"nsites": 4,
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],
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"density": 9.967316664574644,
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"volume": 62.58206556846807,
"volume_molar": 9.421950197621603,
"formula_full": "Mn1 Ag1 Pd2",
"formula_reduced": "MnAgPd2",
"formula_anonymous": "ABC2",
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"spacegroup": 139
}
]
}