# systems

unique_id: de0e799a1eefb0ba81ac10802f5a85c2
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_Wang23/ABC/ClFZn/Cl2F2Zn2-5748e1e27214", "uid": "2ClFZn-1", "olduid": "Cl2F2Zn2-6d78f1352018", "international": "P2_1/m", "number": 11, "has_inversion_symmetry": true, "lgnum": 15, "layergroup": "p2_1/m11", "bravais_type": "Rectangular (op)", "thickness": 2.955120308529934, "label": "Wang23", "gap": 4.077972008060312, "gap_dir": 4.110496034417926, "gap_dir_nosoc": 4.1138399518558435, "evac": 2.634343264614041, "efermi": -5.75115357306178, "vbm": -7.790139577091937, "cbm": -3.7121675690316236, "minhessianeig": -2.676545122388962e-13, "dyn_stab": "Yes", "gap_hse": 5.535399397814436, "gap_dir_hse": 5.567722277575167, "efermi_hse": -6.104168241890607, "vbm_hse": -8.871867940797824, "cbm_hse": -3.3364685429833885, "alphax_el": 0.8984442252829359, "alphay_el": 0.792284448210886, "alphaz_el": 0.2685055542412111, "alphax_lat": 3.187444166029659, "alphax": 4.085888391312595, "alphay_lat": 1.821898553733683, "alphay": 2.6141830019445687, "alphaz_lat": 0.06912038033242544, "alphaz": 0.33762593457363654, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.0414185784604714, "hform": -1.7483772036833962}


unique_id: 3c5174b49e6f05a725e10846efde6f6e
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/ABC/FLiO/F2Li2O2-b828755117a8", "uid": "2FLiO-1", "olduid": "F2Li2O2-b828755117a8", "international": "P2_1/m", "number": 11, "has_inversion_symmetry": true, "lgnum": 15, "layergroup": "p2_1/m11", "bravais_type": "Rectangular (op)", "thickness": 3.5528366196874286, "label": "original03-18", "gap": 2.9124967756051032, "gap_dir": 3.0027968929826305, "gap_dir_nosoc": 3.0030238778517213, "evac": 1.6376833337084977, "efermi": -5.542472983506505, "vbm": -6.998721371309056, "cbm": -4.086224595703953, "minhessianeig": -0.06006567453487757, "dyn_stab": "No", "gap_hse": 5.494371611374226, "gap_dir_hse": 5.589937650569697, "efermi_hse": -5.8484216998623335, "vbm_hse": -8.595607512447321, "cbm_hse": -3.101235901073095, "alphax_el": 0.35669184194093784, "alphay_el": 0.42758391623429587, "alphaz_el": 0.21155199586758233, "plasmafrequency_x": 0.0, "plasmafrequency_y": 0.0, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.8204294624626355, "hform": -1.1971487667939111}


unique_id: 1ba8097aa1eaf73d581b3c9ba0d672e5
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC/FLiO/F2Li2O2-038c78844ff3", "uid": "2FLiO-3", "olduid": "F2Li2O2-7fab9897f23a", "international": "P4/nmm", "number": 129, "has_inversion_symmetry": true, "lgnum": 64, "layergroup": "p4/nmm", "bravais_type": "Square (tp)", "thickness": 3.993102682508554, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.8387166044096658, "hform": -1.1788616248468806}


unique_id: 75ea23c9cb22d46b005115d787894fc4
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC/FLiO/F2Li2O2-b77d52cc52ca", "uid": "2FLiO-2", "olduid": "F2Li2O2-7e30fa18ae8e", "international": "P2_1/m", "number": 11, "has_inversion_symmetry": true, "lgnum": 15, "layergroup": "p2_1/m11", "bravais_type": "Rectangular (op)", "thickness": 4.914735349171931, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.825355166109284, "hform": -1.1922230631472626}


unique_id: 18df9f95867adde770b8e35c20127a6c
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC/GeSSb/Ge4S4Sb4-17c0b575b82b", "uid": "4GeSSb-1", "olduid": "Ge4S4Sb4-87509435e6e4", "international": "P222_1", "number": 17, "has_inversion_symmetry": false, "lgnum": 20, "layergroup": "p2_122", "bravais_type": "Rectangular (op)", "thickness": 3.547231858855703, "label": "Lyngby22_LDP", "gap": 1.7516925796707516, "gap_dir": 1.8110594702244174, "gap_dir_nosoc": 1.9144689124894412, "evac": 1.6676986691694462, "efermi": -4.663271752346626, "vbm": -5.539118042182001, "cbm": -3.7874254625112496, "minhessianeig": -3.1477499437343712e-15, "dyn_stab": "Yes", "gap_hse": 2.4761841002550518, "gap_dir_hse": 2.4920329472115963, "efermi_hse": -4.749137184982413, "vbm_hse": -5.98722923510994, "cbm_hse": -3.5110451348548875, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.0082061719371657, "hform": -0.17664894969913844}


unique_id: 27c3492cf92fd43f11607232dfef66f6
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/ABC/ClOsS/Cl2Os2S2-049500fbee8d", "uid": "2ClOsS-1", "olduid": "Cl2Os2S2-049500fbee8d", "international": "Pmmn", "number": 59, "has_inversion_symmetry": true, "lgnum": 46, "layergroup": "pmmn", "bravais_type": "Rectangular (op)", "thickness": 5.624364939278166, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 4.290872668309143, "efermi": -5.800792884975991, "minhessianeig": -1.6414688669149882e-10, "dyn_stab": "Yes", "alphax_el": 16.97862020988045, "alphay_el": 9.156232908690042, "alphaz_el": 0.538387089167083, "plasmafrequency_x": 2.5056726263766, "plasmafrequency_y": 10.75316134464289, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.21853396469215003, "hform": -0.14058489385084508}


unique_id: a97b24d544cbc238de375af8e2103a3c
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/ICSD-COD/3el/V2Br2O2", "uid": "2BrOV-1", "olduid": "Br2O2V2-c35a3888dc02", "international": "Pmmn", "number": 59, "has_inversion_symmetry": true, "lgnum": 46, "layergroup": "pmmn", "bravais_type": "Rectangular (op)", "thickness": 5.457775559051349, "label": "exfoliated02-21", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 2.303715642266656, "efermi": -5.057209648721415, "minhessianeig": -2.043342753963043e-12, "dyn_stab": "Yes", "alphax_el": 24.179451080535415, "alphay_el": 22.486363109163346, "alphaz_el": 0.5677063392462609, "plasmafrequency_x": 2.770948142011515, "plasmafrequency_y": 5.437122415564265, "cod_id": 1537583, "is_magnetic": true, "spin_axis": "z", "dE_zx": -0.4199763598080608, "dE_zy": -0.08389113349949184, "J": 6.773350595835836, "lam": 0.011095967437313448, "A": 0.11573118325713949, "spin": 1.0, "N_nn": 6, "halfmetal_gap": 2.86430488723681, "halfmetal_gap_dir": 3.0842765050346577, "halfmetal_gap_hse": 5.126531624608862, "halfmetal_gap_dir_hse": 5.362729109159135, "ehull": 0.018649766342405744, "hform": -1.63785958883289}


unique_id: 1decac426939347c5d68831a175d4f5a
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC/NbOS/NbOS-c62e664cff43", "uid": "1NbOS-1", "olduid": "NbOS-583f7498031e", "international": "P3m1", "number": 156, "has_inversion_symmetry": false, "lgnum": 69, "layergroup": "p3m1", "bravais_type": "Hexagonal (hp)", "thickness": 2.7233439900544134, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.2353185716232152, "hform": -1.6810745026998315}


unique_id: 5afa2ac4d59b92cdde6a7fda9a9f2ad2
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/ABC/ClHfO/Cl2Hf2O2-5a9c48d5f462", "uid": "2ClHfO-1", "olduid": "Cl2Hf2O2-5a9c48d5f462", "international": "Pmmn", "number": 59, "has_inversion_symmetry": true, "lgnum": 46, "layergroup": "pmmn", "bravais_type": "Rectangular (op)", "thickness": 5.287452263598713, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 4.040267591539411, "efermi": -4.187104629643447, "minhessianeig": -2.992002803319898, "dyn_stab": "No", "alphax_el": 2.7013027343007705, "alphay_el": 5.95994274999386, "alphaz_el": 0.43261440462947653, "plasmafrequency_x": 7.178061023136457, "plasmafrequency_y": 9.966179247874424, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.1776482005101355, "hform": -2.3542206781503623}


unique_id: 4036b6820e7a904a10ac74091a0d2818
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC/KNiSb/K2Ni2Sb2-5964c8c1b055", "uid": "2KNiSb-1", "olduid": "K2Ni2Sb2-75e0db26b95b", "international": "P4/nmm", "number": 129, "has_inversion_symmetry": true, "lgnum": 64, "layergroup": "p4/nmm", "bravais_type": "Square (tp)", "thickness": 5.332930905780345, "label": "Lyngby22_LDP", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 2.8776164052284057, "efermi": -1.5345007687403467, "minhessianeig": -0.7728565943737521, "dyn_stab": "No", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.09595236571629202, "hform": -0.219490092454001}


unique_id: d1bb8af993fcf08ce18f67e931551b67
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC/GaSeSi/Ga2Se2Si2-15ec1ede8e51", "uid": "2GaSeSi-1", "olduid": "Ga2Se2Si2-52f2e7da757c", "international": "P-3m1", "number": 164, "has_inversion_symmetry": true, "lgnum": 72, "layergroup": "p-3m1", "bravais_type": "Hexagonal (hp)", "thickness": 7.963673132189243, "label": "Lyngby22_LDP", "gap": 1.4117458278560373, "gap_dir": 1.4790244988864525, "gap_dir_nosoc": 1.5139371824226366, "evac": 2.7957895357623173, "efermi": -4.830615422122082, "vbm": -5.536488336050101, "cbm": -4.124742508194064, "minhessianeig": -5.9474552650935225e-15, "dyn_stab": "Yes", "gap_hse": 2.0771230589568357, "gap_dir_hse": 2.1271464855555537, "efermi_hse": -4.893236287547848, "vbm_hse": -5.931797817026265, "cbm_hse": -3.8546747580694296, "alphax_el": 7.008970372573842, "alphay_el": 7.008970372573814, "alphaz_el": 0.7534952104080934, "alphax_lat": 2.50072461576396, "alphax": 9.509694988337802, "alphay_lat": 2.4980994038094426, "alphay": 9.507069776383258, "alphaz_lat": 0.011633398068855895, "alphaz": 0.7651286084769493, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.005838699545858657, "hform": -0.39496290483224544}


unique_id: 9bb1bb2717278135569cf3e2c9552eb2
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC/AsOPt/As4O4Pt4-f452be0c5581", "uid": "4AsOPt-1", "olduid": "As4O4Pt4-ae46c151c576", "international": "P2/c", "number": 13, "has_inversion_symmetry": true, "lgnum": 16, "layergroup": "p2/b11", "bravais_type": "Rectangular (op)", "thickness": 3.918007227735469, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.185701512258338, "hform": -0.5794639089269028}


unique_id: ebc4a78a5f98bc51c3b08e17f98bc8fd
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC/BrSY/Br2S2Y2-4eafee0d0cfc", "uid": "2BrSY-2", "olduid": "Br2S2Y2-cb7eb668fcec", "international": "P-3m1", "number": 164, "has_inversion_symmetry": true, "lgnum": 72, "layergroup": "p-3m1", "bravais_type": "Hexagonal (hp)", "thickness": 7.054906007056797, "label": "Lyngby22_LDP", "gap": 3.07559643706817, "gap_dir": 3.2451748087121137, "gap_dir_nosoc": 3.2629835551195185, "evac": 2.704437442635859, "efermi": -5.051412541510305, "vbm": -6.58921076004439, "cbm": -3.5136143229762204, "minhessianeig": -2.8943810509447854e-16, "dyn_stab": "Yes", "gap_hse": 4.218555790040501, "gap_dir_hse": 4.512306548653054, "efermi_hse": -5.131534981374909, "vbm_hse": -7.240812876395159, "cbm_hse": -3.0222570863546583, "alphax_el": 2.9103009000868942, "alphay_el": 2.9103009000869524, "alphaz_el": 0.5789216210676831, "alphax_lat": 6.475424701465864, "alphax": 9.385725601552759, "alphay_lat": 6.472173597825608, "alphay": 9.382474497912561, "alphaz_lat": 0.09572457486371208, "alphaz": 0.6746461959313952, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.07085055526950867, "hform": -2.0161984224933964}


unique_id: 268acae07b4f483cbba4aa5888b5c689
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_Wang23/ABC/BrSY/Br2S2Y2-32daf628b08e", "uid": "2BrSY-1", "olduid": "Br2S2Y2-dc257343e646", "international": "Pmmn", "number": 59, "has_inversion_symmetry": true, "lgnum": 46, "layergroup": "pmmn", "bravais_type": "Rectangular (op)", "thickness": 6.248957855642768, "label": "Wang23", "gap": 2.9692400623122657, "gap_dir": 2.9692400623122657, "gap_dir_nosoc": 2.994196294814524, "evac": 3.585545369410804, "efermi": -5.352725559540611, "vbm": -6.837345590696744, "cbm": -3.8681055283844783, "minhessianeig": -1.2045962412060543e-12, "dyn_stab": "Yes", "gap_hse": 4.114266001375194, "gap_dir_hse": 4.114266001375194, "efermi_hse": -5.438940996894221, "vbm_hse": -7.496073997581818, "cbm_hse": -3.381807996206624, "alphax_el": 2.440034306670086, "alphay_el": 2.2534181373786044, "alphaz_el": 0.48267292100218623, "alphax_lat": 4.942611026692502, "alphax": 7.382645333362587, "alphay_lat": 5.108927840203769, "alphay": 7.362345977582374, "alphaz_lat": 0.10751771042791912, "alphaz": 0.5901906314301053, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.0, "hform": -2.087048977762905}


unique_id: bdf00908ce0c8c4f760bc7071af941af
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABC/FNbS/FNbS-44bd980bc6b0", "uid": "1FNbS-1", "olduid": "FNbS-58f42cbd0c70", "international": "P3m1", "number": 156, "has_inversion_symmetry": false, "lgnum": 69, "layergroup": "p3m1", "bravais_type": "Hexagonal (hp)", "thickness": 3.0697538383660206, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.32964681981124083, "hform": -1.66644057811646}


unique_id: a641d1fb4cfdb601701f8675340a25f0
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/ABC/ClIrSe/Cl2Ir2Se2-bffe34735848", "uid": "2ClIrSe-1", "olduid": "Cl2Ir2Se2-bffe34735848", "international": "Pmmn", "number": 59, "has_inversion_symmetry": true, "lgnum": 46, "layergroup": "pmmn", "bravais_type": "Rectangular (op)", "thickness": 5.458414350385905, "label": "original03-18", "gap": 0.061521205530018275, "gap_dir": 0.061521205530018275, "gap_dir_nosoc": 0.0, "evac": 4.0154203454991535, "efermi": -5.6168424543656075, "vbm": -5.647603057130617, "cbm": -5.586081851600598, "minhessianeig": -1.1558887107814265e-10, "dyn_stab": "Yes", "gap_hse": 0.6090029142353592, "gap_dir_hse": 0.6090029142353592, "efermi_hse": -5.8974879096789445, "vbm_hse": -6.1877789832055505, "cbm_hse": -5.578776068970191, "alphax_el": 170.72573303820786, "alphay_el": 5.7069434551545015, "alphaz_el": 0.4650847246427519, "alphax_lat": 23194.84362588896, "alphax": 23365.56935892717, "alphay_lat": 1.8877935228316276, "alphay": 7.594736977986129, "alphaz_lat": 0.016400371948876707, "alphaz": 0.48148509659162864, "plasmafrequency_x": 0.5016902572445416, "plasmafrequency_y": 1.2429370990787665, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "topology": "Trivial\n", "ehull": 0.022231148436868537, "hform": -0.4079208191614523}


unique_id: 25e0c1ca7f8ab21ff7219c0c00614d42
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC/ClIrSe/Cl2Ir2Se2-e143d708320f", "uid": "2ClIrSe-2", "olduid": "Cl2Ir2Se2-fffcd3f09395", "international": "P2_1/m", "number": 11, "has_inversion_symmetry": true, "lgnum": 15, "layergroup": "p2_1/m11", "bravais_type": "Rectangular (op)", "thickness": 2.6283109415775137, "label": "Lyngby22_LDP", "gap": 1.187309808676266, "gap_dir": 1.1873584620162827, "gap_dir_nosoc": 1.201121627560644, "evac": 1.922629396579186, "efermi": -4.649208030491219, "vbm": -5.242862934829352, "cbm": -4.055553126153086, "minhessianeig": -3.0871506140361404e-12, "dyn_stab": "Yes", "gap_hse": 2.2350163474245495, "gap_dir_hse": 2.2350163474245495, "efermi_hse": -4.938590736223405, "vbm_hse": -6.05609890993568, "cbm_hse": -3.8210825625111307, "alphax_el": 3.929257093439737, "alphay_el": 3.375872123078391, "alphaz_el": 0.3424244090591252, "alphax_lat": 2.056473444937898, "alphax": 5.985730538377635, "alphay_lat": 1.1743755327446048, "alphay": 4.550247655822996, "alphaz_lat": 0.007042563454154423, "alphaz": 0.34946697251327963, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.03429086650318854, "hform": -0.3958611010951323}


unique_id: e2bd0f6b72302a8748c393fa606ede90
username: cmr
calculator: unknown
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unique_id: d5bba26b308dc941cbf7385a787fe1f8
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
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