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"results": [
{
"id": "mp-1096608",
"created_at": "2022-09-04T14:44:13.182627Z",
"structure_string": "Ba1 Sr1 Tl2\n1.0\n-6.228109 7.204033 10.201383\n6.228109 -7.204033 10.201383\n6.228109 7.204033 -10.201383\nBa Sr Tl\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Ba\n0.000000 0.000000 0.000000 Sr\n0.000000 0.247226 0.247226 Tl\n0.000000 0.752774 0.752774 Tl\n",
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"volume": 1830.8423197800457,
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{
"id": "mp-1226716",
"created_at": "2022-09-04T14:42:02.581837Z",
"structure_string": "Cd1 Ag1\n1.0\n1.701778 -2.414078 0.000000\n1.701778 2.414078 0.000000\n0.000000 0.000000 4.790232\nCd Ag\n1 1\ndirect\n0.500000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Ag\n",
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"updated_at": "2021-11-28T01:35:40.184000Z",
"spacegroup": 65
},
{
"id": "mp-1226726",
"created_at": "2022-09-04T14:40:56.784293Z",
"structure_string": "Cd1 Ag1\n1.0\n4.952694 -1.527641 0.000000\n4.952694 1.527641 0.000000\n4.481499 0.000000 2.603657\nCd Ag\n1 1\ndirect\n0.500000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Ag\n",
"nsites": 2,
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"elements": [
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"density": 9.28423275787772,
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"volume": 39.39821703080705,
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"formula_full": "Cd1 Ag1",
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"formula_anonymous": "AB",
"energy": -3.79279223,
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"energy_above_hull": null,
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"energy_uncorrected": -3.79279223,
"band_gap": 0.0,
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"total_magnetization": 0.000302,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:58.214000Z",
"spacegroup": 166
},
{
"id": "mp-23903",
"created_at": "2022-09-04T14:39:46.021406Z",
"structure_string": "H1 Br1\n1.0\n0.000000 2.445822 2.445822\n2.445822 0.000000 2.445822\n2.445822 2.445822 0.000000\nH Br\n1 1\ndirect\n0.000000 0.000000 0.000000 H\n0.500000 0.500000 0.500000 Br\n",
"nsites": 2,
"nelements": 2,
"elements": [
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"Br"
],
"chemical_system": "Br-H",
"density": 4.591527340139851,
"density_atomic": 0.06834794458090143,
"volume": 29.262035782695108,
"volume_molar": 8.811004920377336,
"formula_full": "H1 Br1",
"formula_reduced": "HBr",
"formula_anonymous": "AB",
"energy": -3.79234398,
"energy_per_atom": -1.89617199,
"energy_above_hull": null,
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"energy_uncorrected": -3.25834398,
"band_gap": 0.0,
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"total_magnetization": 0.0001299,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:29.084000Z",
"spacegroup": 225
},
{
"id": "mp-1093984",
"created_at": "2022-09-04T14:47:04.282827Z",
"structure_string": "Sr1 Li2 In1\n1.0\n-6.302284 6.518525 8.821404\n6.302284 -6.518525 8.821404\n6.302284 6.518525 -8.821404\nSr Li In\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Sr\n0.277335 0.000000 0.277335 Li\n0.722665 0.000000 0.722665 Li\n0.500000 0.000000 0.500000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
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"Li",
"In"
],
"chemical_system": "In-Li-Sr",
"density": 0.2477996923158396,
"density_atomic": 0.0027594020486804327,
"volume": 1449.5894144576832,
"volume_molar": 218.2407874517537,
"formula_full": "Sr1 Li2 In1",
"formula_reduced": "SrLi2In",
"formula_anonymous": "ABC2",
"energy": -3.78868557,
"energy_per_atom": -0.9471713925,
"energy_above_hull": null,
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"updated_at": "2021-11-28T01:37:54.587000Z",
"spacegroup": 71
},
{
"id": "mp-974940",
"created_at": "2022-09-04T14:44:50.926782Z",
"structure_string": "Rb3 Mg1\n1.0\n-3.227267 3.227267 6.187574\n3.227267 -3.227267 6.187574\n3.227267 3.227267 -6.187574\nRb Mg\n3 1\ndirect\n0.500000 0.500000 0.000000 Rb\n0.750000 0.250000 0.500000 Rb\n0.250000 0.750000 0.500000 Rb\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 4,
"nelements": 2,
"elements": [
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],
"chemical_system": "Mg-Rb",
"density": 1.8082326830540096,
"density_atomic": 0.015517072874123995,
"volume": 257.7805770745803,
"volume_molar": 38.80977300842879,
"formula_full": "Rb3 Mg1",
"formula_reduced": "Rb3Mg",
"formula_anonymous": "AB3",
"energy": -3.78851779,
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"is_stable": null,
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"energy_uncorrected": -3.78851779,
"band_gap": 0.0,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:44.284000Z",
"spacegroup": 139
},
{
"id": "mp-1097256",
"created_at": "2022-09-04T14:48:07.692457Z",
"structure_string": "Li2 Ga1 Hg1\n1.0\n-5.460114 5.573614 7.705546\n5.460114 -5.573614 7.705546\n5.460114 5.573614 -7.705546\nLi Ga Hg\n2 1 1\ndirect\n0.244165 0.000000 0.244165 Li\n0.755835 0.000000 0.755835 Li\n0.000000 0.000000 0.000000 Ga\n0.500000 0.000000 0.500000 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
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"Ga",
"Hg"
],
"chemical_system": "Ga-Hg-Li",
"density": 0.5031106641363893,
"density_atomic": 0.004264400483236447,
"volume": 937.9982053102617,
"volume_molar": 141.21893062514437,
"formula_full": "Li2 Ga1 Hg1",
"formula_reduced": "Li2GaHg",
"formula_anonymous": "ABC2",
"energy": -3.77700782,
"energy_per_atom": -0.944251955,
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"is_stable": null,
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"energy_uncorrected": -3.77700782,
"band_gap": 0.0029999999999996,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:38:27.500000Z",
"spacegroup": 71
},
{
"id": "mp-1093728",
"created_at": "2022-09-04T14:41:27.844733Z",
"structure_string": "Ba2 Li1 In1\n1.0\n-6.562014 7.117695 9.055668\n6.562014 -7.117695 9.055668\n6.562014 7.117695 -9.055668\nBa Li In\n2 1 1\ndirect\n0.735056 0.000000 0.735056 Ba\n0.264944 0.000000 0.264944 Ba\n0.000000 0.000000 0.000000 Li\n0.500000 0.000000 0.500000 In\n",
"nsites": 4,
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"elements": [
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"Li",
"In"
],
"chemical_system": "Ba-In-Li",
"density": 0.3890809572953111,
"density_atomic": 0.002364302172408713,
"volume": 1691.8311232294238,
"volume_molar": 254.71112915591237,
"formula_full": "Ba2 Li1 In1",
"formula_reduced": "Ba2LiIn",
"formula_anonymous": "ABC2",
"energy": -3.77665559,
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"energy_above_hull": null,
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"updated_at": "2021-11-28T01:35:19.123000Z",
"spacegroup": 71
},
{
"id": "mp-1184962",
"created_at": "2022-09-04T14:42:55.264184Z",
"structure_string": "K1 Cd3\n1.0\n0.000000 3.910743 3.910743\n3.910743 0.000000 3.910743\n3.910743 3.910743 0.000000\nK Cd\n1 3\ndirect\n0.000000 0.000000 0.000000 K\n0.250000 0.250000 0.250000 Cd\n0.750000 0.750000 0.750000 Cd\n0.500000 0.500000 0.500000 Cd\n",
"nsites": 4,
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"elements": [
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"Cd"
],
"chemical_system": "Cd-K",
"density": 5.2241015760713765,
"density_atomic": 0.0334389141126573,
"volume": 119.6211093016899,
"volume_molar": 18.009378952053048,
"formula_full": "K1 Cd3",
"formula_reduced": "KCd3",
"formula_anonymous": "AB3",
"energy": -3.77415374,
"energy_per_atom": -0.943538435,
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"band_gap": 0.0,
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"updated_at": "2021-11-28T01:35:56.877000Z",
"spacegroup": 225
},
{
"id": "mp-1039148",
"created_at": "2022-09-04T14:42:54.959017Z",
"structure_string": "Ca1 Mg1\n1.0\n3.966138 0.000000 0.000000\n0.000000 3.966138 0.000000\n0.000000 0.000000 3.966138\nCa Mg\n1 1\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Mg\n",
"nsites": 2,
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"elements": [
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"density": 1.7136291574866116,
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"volume": 62.38834479317214,
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"formula_full": "Ca1 Mg1",
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"energy_above_hull": null,
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"updated_at": "2021-11-28T01:36:01.441000Z",
"spacegroup": 221
},
{
"id": "mp-1094998",
"created_at": "2022-09-04T14:39:41.364285Z",
"structure_string": "Ca1 Mg1\n1.0\n4.036242 0.000000 0.000000\n0.000000 4.036242 0.000000\n0.000000 0.000000 3.840635\nCa Mg\n1 1\ndirect\n0.000000 0.000000 0.500000 Ca\n0.500000 0.500000 0.000000 Mg\n",
"nsites": 2,
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"volume": 62.568742956467176,
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"formula_full": "Ca1 Mg1",
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"updated_at": "2021-11-28T01:34:24.457000Z",
"spacegroup": 123
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{
"id": "mp-11472",
"created_at": "2022-09-04T14:46:16.947534Z",
"structure_string": "Sr1 Hg2\n1.0\n2.545483 -4.408907 0.000000\n2.545483 4.408907 0.000000\n0.000000 0.000000 4.043565\nSr Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.666667 0.333333 0.500000 Hg\n0.333333 0.666667 0.500000 Hg\n",
"nsites": 3,
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"elements": [
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"density": 8.943030898776703,
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"volume": 90.76022491045028,
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"formula_full": "Sr1 Hg2",
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"formula_anonymous": "AB2",
"energy": -3.76131893,
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"updated_at": "2021-11-28T01:37:26.125000Z",
"spacegroup": 191
}
]
}