# systems

unique_id: 6cb82deffa99259c472de8f11722b198
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB2C2/PPd2S2/PPd2S2-edc1c0a6cae5", "uid": "1PPd2S2-1", "olduid": "PPd2S2-d9673d11b2aa", "international": "P-6m2", "number": 187, "has_inversion_symmetry": false, "lgnum": 78, "layergroup": "p-6m2", "bravais_type": "Hexagonal (hp)", "thickness": 5.164285078532771, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.26419223232776223, "hform": -0.16726544103697732}


unique_id: 1f0b7998c90e85fa665a6b8066fb8248
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/AB2C2/CI2Zr2/CI2Zr2-3ef148f3c678", "uid": "1CI2Zr2-1", "olduid": "CI2Zr2-7387816fa8a5", "international": "P-3m1", "number": 164, "has_inversion_symmetry": true, "lgnum": 72, "layergroup": "p-3m1", "bravais_type": "Hexagonal (hp)", "thickness": 6.564674255955851, "label": "Lyngby22_CDVAE", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 5.6820999109726, "efermi": -3.7220733362838083, "minhessianeig": -2.837159744241061e-15, "dyn_stab": "Yes", "alphax_el": 135.60125140247527, "alphay_el": 136.16168722374525, "alphaz_el": 0.6627368794706768, "plasmafrequency_x": 4.824666102503217, "plasmafrequency_y": 4.830811506600071, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.0, "hform": -0.9327665150011164}


unique_id: 730892c0c12df0d2be8d6db44439b88b
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_Wang23/AB2C2/CuAg2Te2/CuAg2Te2-978a0b237b6e", "uid": "1CuAg2Te2-1", "olduid": "CuAg2Te2-0d2ce74396a1", "international": "C2/m", "number": 12, "has_inversion_symmetry": true, "lgnum": 18, "layergroup": "c2/m11", "bravais_type": "Centered rectangular (oc)", "thickness": 3.7938481150817847, "label": "Wang23", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 3.9072736063923594, "efermi": -4.792692611152104, "minhessianeig": -1.0139707884129628e-15, "dyn_stab": "No", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.08191617945361254, "hform": 0.00540180874983065}


unique_id: b5d8b108e23f122722be37382c586512
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB2C2/MoF2O2/Mo2F4O4-488ab90e72a8", "uid": "2MoF2O2-1", "olduid": "Mo2F4O4-608d1a7006ee", "international": "Pmc2_1", "number": 26, "has_inversion_symmetry": false, "lgnum": 29, "layergroup": "pb2_1m", "bravais_type": "Rectangular (op)", "thickness": 3.56363366996378, "label": "Lyngby22_LDP", "gap": 2.7965210289293116, "gap_dir": 3.367653986088527, "gap_dir_nosoc": 3.3771483240714693, "evac": 1.2647387382621285, "efermi": -7.569279087036426, "vbm": -8.967539601501082, "cbm": -6.1710185725717706, "minhessianeig": -0.015450384281219264, "dyn_stab": "No", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.0, "hform": -2.411994926407337}


unique_id: 85f78a8e879e02d9f4e8dd322a679dc4
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/AB2C2/CCl2Zr2/CCl2Zr2-8e4323d57563", "uid": "1CCl2Zr2-1", "olduid": "CCl2Zr2-4ebf7f3c1e79", "international": "P-3m1", "number": 164, "has_inversion_symmetry": true, "lgnum": 72, "layergroup": "p-3m1", "bravais_type": "Hexagonal (hp)", "thickness": 5.970805327022198, "label": "Lyngby22_CDVAE", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 5.337119939144808, "efermi": -4.253181916875082, "minhessianeig": -1.2024576283650708e-15, "dyn_stab": "Yes", "alphax_el": 90.16282821919906, "alphay_el": 88.83695541190541, "alphaz_el": 0.5365558977012973, "plasmafrequency_x": 6.801265504613395, "plasmafrequency_y": 6.814922861992737, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.0, "hform": -1.548268850502221}


unique_id: be0c9974aa112c47affc707a62826a6f
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB2C2/CCr2Te2/CCr2Te2-3c6c48d73257", "uid": "1CCr2Te2-1", "olduid": "CCr2Te2-bf07704a9ffd", "international": "P-3m1", "number": 164, "has_inversion_symmetry": true, "lgnum": 72, "layergroup": "p-3m1", "bravais_type": "Hexagonal (hp)", "thickness": 5.732430219957758, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.19754002407975157, "hform": 0.016148227035988328}


unique_id: 397e0cf3cc7779f874b1eefcf868c33a
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB2C2/AgNa2S2/AgNa2S2-e48587f04d28", "uid": "1AgNa2S2-1", "olduid": "AgNa2S2-c287f0801a8b", "international": "C2/m", "number": 12, "has_inversion_symmetry": true, "lgnum": 18, "layergroup": "c2/m11", "bravais_type": "Centered rectangular (oc)", "thickness": 2.7132911294235456, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.2730310572346511, "hform": -0.4645218523758416}


unique_id: 93187b1c7cb7dad17c319bdd01f7e9c1
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB2C2/SeO2Sb2/SeO2Sb2-1bcc33c9e583", "uid": "1SeO2Sb2-1", "olduid": "SeO2Sb2-5b7376ee066f", "international": "P-3m1", "number": 164, "has_inversion_symmetry": true, "lgnum": 72, "layergroup": "p-3m1", "bravais_type": "Hexagonal (hp)", "thickness": 5.629197955732488, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.3388537696951433, "hform": -0.6566625240823427}


unique_id: f487bf351340cd77b223645aacd796d6
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB2C2/BMo2Te2/BMo2Te2-620507800a54", "uid": "1BMo2Te2-1", "olduid": "BMo2Te2-b78878e3277f", "international": "P-3m1", "number": 164, "has_inversion_symmetry": true, "lgnum": 72, "layergroup": "p-3m1", "bravais_type": "Hexagonal (hp)", "thickness": 6.167169430770475, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.14884816665493336, "hform": -0.25022123057033385}


unique_id: 832d797c7a538b04363c1e056aecd2ec
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB2C2/NO2Zr2/NO2Zr2-a77b9781ca4b", "uid": "1NO2Zr2-1", "olduid": "NO2Zr2-a77b9781ca4b", "international": "P-3m1", "number": 164, "has_inversion_symmetry": true, "lgnum": 72, "layergroup": "p-3m1", "bravais_type": "Hexagonal (hp)", "thickness": 4.646311250887843, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 5.177822879143678, "efermi": -4.730528298643339, "minhessianeig": -6.345316709869514e-15, "dyn_stab": "Yes", "alphax_el": 4.457051972229371, "alphay_el": 4.457051972229366, "alphaz_el": 0.4127422243084782, "plasmafrequency_x": 7.168769400362389, "plasmafrequency_y": 7.168769400362391, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.20386724015180063, "hform": -2.615726845128846}


unique_id: d37bdaca41bfdf5a12b00394e2c27031
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB2C2/MgH2Se2/MgH2Se2-d7eb2db911e3", "uid": "1MgH2Se2-1", "olduid": "MgH2Se2-aea8d8b1b40e", "international": "P-3m1", "number": 164, "has_inversion_symmetry": true, "lgnum": 72, "layergroup": "p-3m1", "bravais_type": "Hexagonal (hp)", "thickness": 5.512995616848155, "label": "Lyngby22_LDP", "gap": 2.7498374710871807, "gap_dir": 2.7498374710871807, "gap_dir_nosoc": 2.878508919726414, "evac": 2.175110135026037, "efermi": -3.4653772111424175, "vbm": -4.840295946686007, "cbm": -2.090458475598827, "minhessianeig": -6.998940278299614e-15, "dyn_stab": "Yes", "gap_hse": 3.727194633026653, "gap_dir_hse": 3.727194633026653, "efermi_hse": -3.617753934167838, "vbm_hse": -5.481351250681165, "cbm_hse": -1.7541566176545116, "alphax_el": 1.5216134741126257, "alphay_el": 1.5191811444479204, "alphaz_el": 0.37144374327104485, "alphax_lat": 2.34053259659646, "alphax": 3.8621460707090858, "alphay_lat": 2.291942306220173, "alphay": 3.8111234506680933, "alphaz_lat": 0.04090523592577413, "alphaz": 0.41234897919681895, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.029771375566862268, "hform": -0.475460123343337}


unique_id: d8f489575ac7ae70ac3b03c5e2a25bcb
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/ICSD-COD/3el/O4S8Sb8", "uid": "4OS2Sb2-1", "olduid": "O4S8Sb8-dcb4784647b2", "international": "P-1", "number": 2, "has_inversion_symmetry": true, "lgnum": 2, "layergroup": "p-1", "bravais_type": "Oblique (mp)", "thickness": 3.4322012747466886, "label": "exfoliated02-21", "gap": 1.8792476453553875, "gap_dir": 1.8792476453553875, "gap_dir_nosoc": 1.9605886395112442, "evac": 1.5612417153728737, "efermi": -4.447712748983993, "vbm": -5.387336571661686, "cbm": -3.508088926306299, "minhessianeig": -1.4555493835955531e-15, "dyn_stab": "Yes", "gap_hse": 2.7289556239146453, "gap_dir_hse": 2.7289556239146453, "efermi_hse": -4.586506841843637, "vbm_hse": -5.95098465380096, "cbm_hse": -3.222029029886315, "cod_id": 9009342, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.013823616181211574, "hform": -0.6239530806029997}


unique_id: 61eb320cd8ee408a3b2fe15e0db953f6
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB2C2/WF2O2/W2F4O4-e730de9da953", "uid": "2WF2O2-1", "olduid": "W2F4O4-bf0d40f24512", "international": "Pmc2_1", "number": 26, "has_inversion_symmetry": false, "lgnum": 29, "layergroup": "pb2_1m", "bravais_type": "Rectangular (op)", "thickness": 3.654451123010425, "label": "Lyngby22_LDP", "gap": 2.359577213631714, "gap_dir": 3.257055432454326, "gap_dir_nosoc": 3.3254810443835874, "evac": 1.3614469310771256, "efermi": -7.609620786365753, "vbm": -8.789409393181609, "cbm": -6.429832179549895, "minhessianeig": -1.4511060746053323e-12, "dyn_stab": "Yes", "gap_hse": 3.972017419309762, "gap_dir_hse": 4.935711508006589, "efermi_hse": -7.973042003287748, "vbm_hse": -9.959050712942629, "cbm_hse": -5.987033293632867, "alphax_el": 0.937958130781311, "alphay_el": 0.9708362617483399, "alphaz_el": 0.21891800632043684, "alphax_lat": 1.799337805691787, "alphax": 2.7372959364730978, "alphay_lat": 2.476509718819974, "alphay": 3.447345980568314, "alphaz_lat": 0.05487318561711831, "alphaz": 0.27379119193755513, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.0, "hform": -2.5896597242365167}


unique_id: 8d1d23f62423d8f9a2862c6191ccaa81
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB2C2/SnF2S2/SnF2S2-1f2bd4ed27b4", "uid": "1SnF2S2-1", "olduid": "SnF2S2-c2df1552658b", "international": "C2/m", "number": 12, "has_inversion_symmetry": true, "lgnum": 18, "layergroup": "c2/m11", "bravais_type": "Centered rectangular (oc)", "thickness": 5.497465789796352, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.747540570581938, "hform": -0.6813508000684372}


unique_id: f14933f969a6cab781a2085e67df2bab
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB2C2/CNb2Te2/CNb2Te2-f69ad06def02", "uid": "1CNb2Te2-1", "olduid": "CNb2Te2-48805af081bf", "international": "P-3m1", "number": 164, "has_inversion_symmetry": true, "lgnum": 72, "layergroup": "p-3m1", "bravais_type": "Hexagonal (hp)", "thickness": 6.32686334901476, "label": "Lyngby22_LDP", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 6.912559352950888, "efermi": -4.430787086018711, "minhessianeig": -1.7950647516354218e-14, "dyn_stab": "Yes", "alphax_el": 173.0318674392224, "alphay_el": 173.22492491052915, "alphaz_el": 0.6914445031209718, "plasmafrequency_x": 3.808706880552924, "plasmafrequency_y": 3.8160593944741477, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.0, "hform": -0.5576193594129351}


unique_id: 47fb7517c617202cacc668d407d1fa9c
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB2C2/TlF2O2/TlF2O2-3c41e0b881fe", "uid": "1TlF2O2-1", "olduid": "TlF2O2-27ae5d8c93aa", "international": "P-3m1", "number": 164, "has_inversion_symmetry": true, "lgnum": 72, "layergroup": "p-3m1", "bravais_type": "Hexagonal (hp)", "thickness": 5.23898284445446, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.7846954048163385, "hform": -0.3709309676868628}


unique_id: c42d92eaee9a42f3c07ebaddd92cc942
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB2C2/TeAs2S2/TeAs2S2-04252b305d2a", "uid": "1TeAs2S2-1", "olduid": "TeAs2S2-94c1afa04611", "international": "C2", "number": 5, "has_inversion_symmetry": false, "lgnum": 10, "layergroup": "c211", "bravais_type": "Centered rectangular (oc)", "thickness": 6.547678337029884, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.12233115190012359, "hform": 0.0063469516597628225}


unique_id: 7afdf77d686b76597163f66ae22443ce
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB2C2/SeP2Te2/SeP2Te2-17511e31bbfa", "uid": "1SeP2Te2-1", "olduid": "SeP2Te2-4016cf008256", "international": "P-3m1", "number": 164, "has_inversion_symmetry": true, "lgnum": 72, "layergroup": "p-3m1", "bravais_type": "Hexagonal (hp)", "thickness": 6.3407247654211725, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.1518773905485067, "hform": 0.11874696898342237}


unique_id: b8339940554828fe82726cf47329ffaa
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB2C2/NH2Nb2/NH2Nb2-812c43e9b300", "uid": "1NH2Nb2-1", "olduid": "NH2Nb2-2e8c98089688", "international": "P-3m1", "number": 164, "has_inversion_symmetry": true, "lgnum": 72, "layergroup": "p-3m1", "bravais_type": "Hexagonal (hp)", "thickness": 4.873422322279932, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.19851191937828574, "hform": -0.4547320354300197}


unique_id: bed98426c7a08356a3547e01d724a8b7
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_Wang23/AB2C2/ZrBr2Se2/Zr2Br4Se4-fb358997df80", "uid": "2ZrBr2Se2-1", "olduid": "Zr2Br4Se4-8a278985685e", "international": "C2/m", "number": 12, "has_inversion_symmetry": true, "lgnum": 18, "layergroup": "c2/m11", "bravais_type": "Centered rectangular (oc)", "thickness": 4.29432998145364, "label": "Wang23", "gap": 1.3809286476033138, "gap_dir": 1.4385393147325365, "gap_dir_nosoc": 1.475863196160333, "evac": 3.2030345701639433, "efermi": -5.146989647605986, "vbm": -5.837453971407644, "cbm": -4.45652532380433, "minhessianeig": -1.007816540383872e-15, "dyn_stab": "Yes", "gap_hse": 2.45110604319439, "gap_dir_hse": 2.4978989386826465, "efermi_hse": -5.084866625217946, "vbm_hse": -6.310419646815141, "cbm_hse": -3.8593136036207505, "alphax_el": 2.475704257072273, "alphay_el": 2.62852795831209, "alphaz_el": 0.39532637077501126, "alphax_lat": 1.5446684960627044, "alphax": 4.0203727531349776, "alphay_lat": 2.088059077162364, "alphay": 4.716587035474454, "alphaz_lat": 0.016633219940012933, "alphaz": 0.4119595907150242, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.0, "hform": -1.1667610236656067}


unique_id: ae28a1be5d0a276c4bf7daacac22bc35
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_Wang23/AB2C2/NbS2Se2/Nb2S4Se4-dec67670c7fb", "uid": "2NbS2Se2-1", "olduid": "Nb2S4Se4-7b92b75b620e", "international": "C2/m", "number": 12, "has_inversion_symmetry": true, "lgnum": 18, "layergroup": "c2/m11", "bravais_type": "Centered rectangular (oc)", "thickness": 4.0721190944955845, "label": "Wang23", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 3.8854588797555625, "efermi": -5.344623514641189, "minhessianeig": -2.9508045031322276e-15, "dyn_stab": "Yes", "alphax_el": 27.671980875989412, "alphay_el": 8.166257231579543, "alphaz_el": 0.415590849688646, "plasmafrequency_x": 2.6427545026539225, "plasmafrequency_y": 8.178479719198307, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.08940353268390008, "hform": -0.5613751907688475}


unique_id: 7fb60e0b6c56c7c0f9a375e9ae485aba
username: cmr
calculator: unknown
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