# systems

unique_id: 1c7d146ba67a1c98cc330cdb0376f2a3
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB2/AgBr2/Ag2Br4-2f6adf602fef", "uid": "2AgBr2-2", "olduid": "Ag2Br4-2f6adf602fef", "international": "C2/m", "number": 12, "has_inversion_symmetry": true, "lgnum": 18, "layergroup": "c2/m11", "bravais_type": "Centered rectangular (oc)", "thickness": 3.0882929203431164, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 2.849297656613814, "efermi": -6.557215715781289, "minhessianeig": -1.114749613512964, "dyn_stab": "No", "alphax_el": 6.932008383309927, "alphay_el": 9.853679402969197, "alphaz_el": 0.3645060791368391, "plasmafrequency_x": 3.7412634299088356, "plasmafrequency_y": 5.3675017925152435, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.037826367740419996, "hform": -0.20397679984389475}


unique_id: edab79079a2d07d9ec8e2ad5dc30d674
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/push-manti-tree/AB2/1/Ag2Br4-AB2-1-a-0", "uid": "2AgBr2-1", "olduid": "Ag2Br4-8d78c4e917b0", "international": "P2_1/c", "number": 14, "has_inversion_symmetry": true, "lgnum": 17, "layergroup": "p2_1/b11", "bravais_type": "Rectangular (op)", "thickness": 3.015601937645102, "label": "Manti22_pushed", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 2.6529417089860314, "efermi": -6.295909449820815, "minhessianeig": -5.173761775866206, "dyn_stab": "No", "is_magnetic": true, "spin_axis": "x", "dE_zx": 1.4203637929313118, "dE_zy": -4.862477643882812, "ehull": 0.0005875341943824367, "hform": -0.24121563338993232}


unique_id: bd74bd3a59072101dd57f892f40c7a85
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_Wang23/AB2/AgI2/Ag6I12-259a56fe580d", "uid": "6AgI2-1", "olduid": "Ag6I12-93df3de0b4f3", "international": "P1", "number": 1, "has_inversion_symmetry": false, "lgnum": 1, "layergroup": "p1", "bravais_type": "Oblique (mp)", "thickness": 4.321655330016083, "label": "Wang23", "gap": 1.1234992397600276, "gap_dir": 1.1640915461120729, "gap_dir_nosoc": 1.3240891047951506, "evac": 2.4218939208454975, "efermi": -5.25255471818209, "vbm": -5.8143043380621044, "cbm": -4.690805098302077, "minhessianeig": -5.509135077137508e-16, "dyn_stab": "Yes", "gap_hse": 1.95635938183172, "gap_dir_hse": 1.9805522554407249, "efermi_hse": -5.546348814188635, "vbm_hse": -6.524528505104495, "cbm_hse": -4.568169123272775, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.022592376192903812, "hform": -0.156681807761749}


unique_id: a3c660ffd6f5fb42d0fa89cc4fdf571c
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB2/YSe2/YSe2-a1f75ad3deac", "uid": "1YSe2-1", "olduid": "YSe2-a1f75ad3deac", "international": "P-4m2", "number": 115, "has_inversion_symmetry": false, "lgnum": 59, "layergroup": "p-4m2", "bravais_type": "Square (tp)", "thickness": 3.6037058328166207, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 2.8740208622616388, "efermi": -6.653848074576263, "minhessianeig": -1.3299557353105553, "dyn_stab": "No", "alphax_el": 18.51610163545023, "alphay_el": 18.63390702832464, "alphaz_el": 0.39382548200925427, "plasmafrequency_x": 5.307819125810793, "plasmafrequency_y": 5.324650938606451, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.488582174745126, "hform": -0.9186915853844558}


unique_id: 85067ba336f15a7673fb0a82d038df31
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/ICSD-COD/2el/Al4O8", "uid": "2AlO2-2", "olduid": "Al2O4-b003ee55f237", "international": "Pmmn", "number": 59, "has_inversion_symmetry": true, "lgnum": 46, "layergroup": "pmmn", "bravais_type": "Rectangular (op)", "thickness": 4.113565805491719, "label": "exfoliated02-21", "gap": 0.0165729589321284, "gap_dir": 0.2585206961603461, "gap_dir_nosoc": 0.2586470373409151, "evac": 2.0208475192329045, "efermi": -8.44548415981131, "vbm": -8.453770639277373, "cbm": -8.437197680345246, "minhessianeig": -3.067620864743055e-12, "dyn_stab": "Yes", "gap_hse": 1.6450864500759126, "gap_dir_hse": 1.9861925421497553, "efermi_hse": -8.699371927065968, "vbm_hse": -9.521915152103924, "cbm_hse": -7.876828702028011, "alphax_el": 7.459398635114391, "alphay_el": 8.530729100584486, "alphaz_el": 0.3682219195520618, "cod_id": 9012273, "is_magnetic": true, "spin_axis": "x", "dE_zx": 0.03420595692205097, "dE_zy": -0.019280317928860313, "topology": "Trivial", "ehull": 0.48445470379161026, "hform": -2.0109637841930503}


unique_id: 2685bbbdbead0981d7d3e7a51ba060ba
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB2/AlO2/Al2O4-7e14f34fd9ab", "uid": "2AlO2-1", "olduid": "Al2O4-0ff0ed592958", "international": "P-3m1", "number": 164, "has_inversion_symmetry": true, "lgnum": 72, "layergroup": "p-3m1", "bravais_type": "Hexagonal (hp)", "thickness": 1.7967390268426646, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.47224215564743205, "hform": -2.0231763323372287}


unique_id: 7f1bc6ef21cdb1d20238eae0a31d1551
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB2/HgS2/HgS2-1ab075eddd3f", "uid": "1HgS2-1", "olduid": "HgS2-1ab075eddd3f", "international": "P-6m2", "number": 187, "has_inversion_symmetry": false, "lgnum": 78, "layergroup": "p-6m2", "bravais_type": "Hexagonal (hp)", "thickness": 2.2801586807647576, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 2.4546333784652825, "efermi": -5.213156103875126, "minhessianeig": -9.013123585728335, "dyn_stab": "No", "alphax_el": 1.7958315711508324, "alphay_el": 1.7958315711508313, "alphaz_el": 0.2959891750996302, "plasmafrequency_x": 4.256320730668343, "plasmafrequency_y": 4.256320730668343, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.5744308782251769, "hform": 0.4432535594540979}


unique_id: 92e84d462542be1744c868a3b6b5e661
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB2/HgS2/HgS2-c2fda73df6e4", "uid": "1HgS2-2", "olduid": "HgS2-c2fda73df6e4", "international": "P-3m1", "number": 164, "has_inversion_symmetry": true, "lgnum": 72, "layergroup": "p-3m1", "bravais_type": "Hexagonal (hp)", "thickness": 2.798748944282103, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 3.1016323265991868, "efermi": -6.095241649023803, "dyn_stab": "Unknown", "alphax_el": 33.5771800229991, "alphay_el": 33.57718002299908, "alphaz_el": 0.44016934031154553, "plasmafrequency_x": 2.919489133301268, "plasmafrequency_y": 2.919489133301268, "is_magnetic": true, "spin_axis": "z", "dE_zx": -0.20478187559547223, "dE_zy": -0.20468025547870639, "J": 6.686745060985938, "lam": 0.006839346358194436, "A": 0.0841038946646222, "spin": 1.0, "N_nn": 9, "ehull": 0.6729004840528979, "hform": 0.541723165281819}


unique_id: b5154f02c4819af02766f056c8e15336
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB2/HgS2/HgS2-fa9ebc098098", "uid": "1HgS2-3", "olduid": "HgS2-fa9ebc098098", "international": "P-4m2", "number": 115, "has_inversion_symmetry": false, "lgnum": 59, "layergroup": "p-4m2", "bravais_type": "Square (tp)", "thickness": 4.160382644212925, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 4.151928232040564, "efermi": -5.841366658614565, "minhessianeig": -1.2985338046103547, "dyn_stab": "No", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.6894191543467798, "hform": 0.5582418355757008}


unique_id: e8dca6efbd619473378b60f354042531
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB2/AgS2/Ag2S4-6f1b5ccc63c1", "uid": "2AgS2-1", "olduid": "Ag2S4-6f1b5ccc63c1", "international": "P2_1/c", "number": 14, "has_inversion_symmetry": true, "lgnum": 17, "layergroup": "p2_1/b11", "bravais_type": "Rectangular (op)", "thickness": 1.1194244178090358, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 2.2146037531321654, "efermi": -4.8377097412782595, "minhessianeig": -0.12172689674790325, "dyn_stab": "No", "alphax_el": 14.53047000302379, "alphay_el": 18.955070963758928, "alphaz_el": 0.2229373658429108, "plasmafrequency_x": 4.1337259999470515, "plasmafrequency_y": 6.088142760819722, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.10395493079203148, "hform": 0.06633087675577383}


unique_id: dd5cf0c10b52b0ba13ef7611900ee982
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB2/AgS2/Ag2S4-36ad78d2efd5", "uid": "2AgS2-2", "olduid": "Ag2S4-c77ef9565c5b", "international": "C2/m", "number": 12, "has_inversion_symmetry": true, "lgnum": 18, "layergroup": "c2/m11", "bravais_type": "Centered rectangular (oc)", "thickness": 0.9054085471092215, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.4102269323424131, "hform": 0.37260287830615546}


unique_id: 5a41a1904fedf932e147f4cfad00153e
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB2/GeSb2/Ge4Sb8-db171e99bd3e", "uid": "4GeSb2-1", "olduid": "Ge4Sb8-034423cf6a88", "international": "Pmc2_1", "number": 26, "has_inversion_symmetry": false, "lgnum": 28, "layergroup": "pm2_1b", "bravais_type": "Rectangular (op)", "thickness": 6.657436876434959, "label": "Lyngby22_LDP", "gap": 0.9419590161864018, "gap_dir": 0.9833036977641032, "gap_dir_nosoc": 1.0775405807773306, "evac": 2.0870818328585803, "efermi": -4.189058893112467, "vbm": -4.660038401205668, "cbm": -3.7180793850192666, "minhessianeig": -5.63719641086819e-14, "dyn_stab": "Yes", "gap_hse": 1.3329595064349289, "gap_dir_hse": 1.3934607138333122, "efermi_hse": -4.21462855706392, "vbm_hse": -4.881108310281384, "cbm_hse": -3.5481488038464546, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.05126342753717839, "hform": 0.05126342753717831}


unique_id: 96cf4a5a30a3976d47623b86cbcf32a5
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB2/HfCl2/HfCl2-7c0d7c203e3c", "uid": "1HfCl2-3", "olduid": "HfCl2-7c0d7c203e3c", "international": "P-4m2", "number": 115, "has_inversion_symmetry": false, "lgnum": 59, "layergroup": "p-4m2", "bravais_type": "Square (tp)", "thickness": 3.9128382940567956, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 3.8119505414696286, "efermi": -4.858451780795386, "minhessianeig": -1.079338358438927, "dyn_stab": "No", "alphax_el": 5.316618158645019, "alphay_el": 5.305399411663061, "alphaz_el": 0.37551486712452437, "plasmafrequency_x": 7.300382314439047, "plasmafrequency_y": 7.307394335853022, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.4479655076915107, "hform": -1.0987854516491324}


unique_id: 765e3b3ac754e35fb95c3560bd7344d0
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB2/HfCl2/HfCl2-864f8b497185", "uid": "1HfCl2-1", "olduid": "HfCl2-864f8b497185", "international": "P-6m2", "number": 187, "has_inversion_symmetry": false, "lgnum": 78, "layergroup": "p-6m2", "bravais_type": "Hexagonal (hp)", "thickness": 3.4599141836685092, "label": "original03-18", "gap": 0.9080015510264763, "gap_dir": 1.7226483169386508, "gap_dir_nosoc": 1.7946153810376346, "evac": 4.035370111961512, "efermi": -3.245230605150719, "vbm": -3.6992313806639574, "cbm": -2.791229829637481, "minhessianeig": -1.6867456522349848e-15, "dyn_stab": "Yes", "gap_hse": 1.4708526062518574, "gap_dir_hse": 2.3430855878067365, "efermi_hse": -3.192752955324771, "vbm_hse": -3.8782396732837423, "cbm_hse": -2.407387067031885, "gap_gw": 2.0915107901850156, "gap_dir_gw": 2.880235557365713, "efermi_gw": -3.3702163817308683, "vbm_gw": -4.373244361870824, "cbm_gw": -2.281733571685808, "E_B": 0.9136897516752635, "alphax_el": 4.3666701074707985, "alphay_el": 4.366670107470802, "alphaz_el": 0.355142486488411, "alphax_lat": 0.39769700775630534, "alphax": 4.764367115227104, "alphay_lat": 0.3949851534352501, "alphay": 4.7616552609060525, "alphaz_lat": 0.01059161752017844, "alphaz": 0.36573410400858947, "plasmafrequency_x": 0.0, "plasmafrequency_y": 0.0, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.00681337844221197, "hform": -1.539937580898431}


unique_id: 96d2eaa8f49cb09d6e828436ed1fa6f5
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB2/HfCl2/HfCl2-9c3b0666d92b", "uid": "1HfCl2-2", "olduid": "HfCl2-9c3b0666d92b", "international": "P-3m1", "number": 164, "has_inversion_symmetry": true, "lgnum": 72, "layergroup": "p-3m1", "bravais_type": "Hexagonal (hp)", "thickness": 3.6345399902615085, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 4.258520789813128, "efermi": -4.084528996662288, "minhessianeig": -8.511508980636432, "dyn_stab": "No", "alphax_el": 18.071430925698476, "alphay_el": 18.071430925698476, "alphaz_el": 0.3775120892745763, "plasmafrequency_x": 7.431524186848868, "plasmafrequency_y": 7.431524186848869, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.13517536730024915, "hform": -1.4115755920403938}


unique_id: 975a35052421be061e8f1da1f0e6c209
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB2/PbH2/PbH2-fc8da8da266b", "uid": "1PbH2-1", "olduid": "PbH2-b3876b0602a5", "international": "P-4m2", "number": 115, "has_inversion_symmetry": false, "lgnum": 59, "layergroup": "p-4m2", "bravais_type": "Square (tp)", "thickness": 1.745288389915098, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.4966555278324924, "hform": 0.4966555278324923}


unique_id: a6253b4c4cbe3c6027ffafcf88da5b52
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB2/CaCl2/Ca2Cl4-047cf441c6ef", "uid": "2CaCl2-2", "olduid": "Ca2Cl4-cf9d71abdd09", "international": "P4/nmm", "number": 129, "has_inversion_symmetry": true, "lgnum": 64, "layergroup": "p4/nmm", "bravais_type": "Square (tp)", "thickness": 5.687060015250509, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.2921056815131348, "hform": -2.139046646285171}


unique_id: f3556044d5afc06ee11c3ad6693e1fbd
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_Wang23/AB2/CaCl2/Ca2Cl4-3f08676693bd", "uid": "2CaCl2-1", "olduid": "Ca2Cl4-fb51e499cf50", "international": "Pmmn", "number": 59, "has_inversion_symmetry": true, "lgnum": 46, "layergroup": "pmmn", "bravais_type": "Rectangular (op)", "thickness": 2.932230853463686, "label": "Wang23", "gap": 5.406327483393074, "gap_dir": 5.454640068996971, "gap_dir_nosoc": 5.459315395003538, "evac": 2.6745604622862906, "efermi": -4.977670199569803, "vbm": -7.68083394126634, "cbm": -2.274506457873266, "minhessianeig": -1.0870524641834867e-13, "dyn_stab": "Yes", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.06250870283173082, "hform": -2.368643624966575}


unique_id: 701c8b6b052d3373020087a3e7029d7e
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB2/AgCl2/AgCl2-5d923329973d", "uid": "1AgCl2-3", "olduid": "AgCl2-5d923329973d", "international": "P-6m2", "number": 187, "has_inversion_symmetry": false, "lgnum": 78, "layergroup": "p-6m2", "bravais_type": "Hexagonal (hp)", "thickness": 3.2340675997474913, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 3.0936829555240775, "efermi": -7.29031596408281, "minhessianeig": -6.271502125718302, "dyn_stab": "No", "alphax_el": 28.595364463957353, "alphay_el": 28.595364463957367, "alphaz_el": 0.3845727901012052, "plasmafrequency_x": 2.0362464504262836, "plasmafrequency_y": 2.0362464504262836, "is_magnetic": true, "spin_axis": "y", "dE_zx": 0.21664466066795285, "dE_zy": 0.216819942352231, "J": 27.51165748713902, "lam": 0.04487700243771542, "A": 0.0, "spin": 0.5, "N_nn": 6, "ehull": 0.19508389772297688, "hform": -0.16879797437074698}


unique_id: dd07a309f369172788f847a2d5b9577b
username: cmr
calculator: unknown
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