# systems

unique_id: ece59024963622f9f869b780fd8d77b9
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_Wang23/AB3/TlI3/Tl2I6-befc9dc818d5", "uid": "2TlI3-3", "olduid": "Tl2I6-d04940efad95", "international": "Pmma", "number": 51, "has_inversion_symmetry": true, "lgnum": 41, "layergroup": "pmma", "bravais_type": "Rectangular (op)", "thickness": 5.903383311593383, "label": "Wang23", "gap": 1.568337607034287, "gap_dir": 1.568337607034287, "gap_dir_nosoc": 1.83828904671727, "evac": 2.7654740243029736, "efermi": -4.897772434450468, "vbm": -5.681941237967612, "cbm": -4.1136036309333255, "minhessianeig": -0.03345262681024506, "dyn_stab": "No", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.008661293761957456, "hform": -0.3363296563153124}


unique_id: 3a01c46353060ac1744be1f313cee050
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB3/AsI3/As2I6-7c51a624bf63", "uid": "2AsI3-1", "olduid": "As2I6-7c51a624bf63", "international": "P-31m", "number": 162, "has_inversion_symmetry": true, "lgnum": 71, "layergroup": "p-31m", "bravais_type": "Hexagonal (hp)", "thickness": 3.3660464491184836, "label": "original03-18", "gap": 1.9113700539032834, "gap_dir": 2.0127254970437574, "gap_dir_nosoc": 2.327213510976595, "evac": 3.0893673845893357, "efermi": -5.073364779672894, "vbm": -6.029049806624536, "cbm": -4.117679752721252, "minhessianeig": -4.540461441297543e-16, "dyn_stab": "Yes", "gap_hse": 2.625028652121637, "gap_dir_hse": 2.749056319374288, "efermi_hse": -5.007742036442307, "vbm_hse": -6.5196533705552735, "cbm_hse": -3.894624718433636, "alphax_el": 3.5650823237006346, "alphay_el": 3.5650823237006355, "alphaz_el": 0.42490585286308535, "alphax_lat": 9.108530008600452, "alphax": 12.673612332301087, "alphay_lat": 9.122320488176634, "alphay": 12.68740281187727, "alphaz_lat": 0.03736632348955819, "alphaz": 0.46227217635264356, "plasmafrequency_x": 0.0, "plasmafrequency_y": 0.0, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.001641744038340942, "hform": -0.2098848077254618}


unique_id: 8b6aff87d84f62fe5e1fdd4f72f44105
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB3/YF3/Y2F6-35ebeed8bc7d", "uid": "2YF3-1", "olduid": "Y2F6-0d0295484e89", "international": "P-31m", "number": 162, "has_inversion_symmetry": true, "lgnum": 71, "layergroup": "p-31m", "bravais_type": "Hexagonal (hp)", "thickness": 2.270601618626987, "label": "Lyngby22_LDP", "gap": 7.72766527046932, "gap_dir": 7.72766527046932, "gap_dir_nosoc": 7.729525547553088, "evac": 2.020684563785604, "efermi": -5.93409749471796, "vbm": -9.797930129952622, "cbm": -2.070264859483301, "minhessianeig": -1.7258873836109684e-15, "dyn_stab": "Yes", "gap_hse": 9.894449577438952, "gap_dir_hse": 9.894449577438952, "efermi_hse": -6.694568175589618, "vbm_hse": -11.641792964309094, "cbm_hse": -1.7473433868701427, "alphax_el": 0.37167875666126304, "alphay_el": 0.3716787566612661, "alphaz_el": 0.1640287522884092, "alphax_lat": 1.0605216800222774, "alphax": 1.4322004366835404, "alphay_lat": 1.0605214961173395, "alphay": 1.4322002527786055, "alphaz_lat": 0.12950878544171773, "alphaz": 0.2935375377301269, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.0, "hform": -4.154190271185107}


unique_id: a13e8235e7f6b65196a3537f55844b42
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB3/YF3/Y2F6-fb2ba345bd85", "uid": "2YF3-2", "olduid": "Y2F6-cc0b329c9028", "international": "P6/mmm", "number": 191, "has_inversion_symmetry": true, "lgnum": 80, "layergroup": "p6/mmm", "bravais_type": "Hexagonal (hp)", "thickness": 2.5139740532334844, "label": "Lyngby22_LDP", "gap": 6.821395567485379, "gap_dir": 6.946183856191887, "gap_dir_nosoc": 6.947990856825636, "evac": 2.0465570444117773, "efermi": -6.4817700133010065, "vbm": -9.892467797043697, "cbm": -3.0710722295583173, "minhessianeig": -0.43130142002837835, "dyn_stab": "No", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.0285896611635712, "hform": -4.125600610021536}


unique_id: 8444f485aacc29922b26f1f0574d1e9e
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB3/CrBr3/Cr2Br6-e406fd4547de", "uid": "2CrBr3-1", "olduid": "Cr2Br6-e406fd4547de", "international": "P-31m", "number": 162, "has_inversion_symmetry": true, "lgnum": 71, "layergroup": "p-31m", "bravais_type": "Hexagonal (hp)", "thickness": 2.8778925141538085, "label": "original03-18", "gap": 1.5095584261634603, "gap_dir": 1.5181377264612004, "gap_dir_nosoc": 1.5257121970685494, "evac": 2.880865252182299, "efermi": -5.583381296844493, "vbm": -6.338160509926223, "cbm": -4.828602083762763, "minhessianeig": -6.881701566282903e-15, "dyn_stab": "Yes", "gap_hse": 3.4305610727440685, "gap_dir_hse": 3.480300745619851, "efermi_hse": -5.830783039172841, "vbm_hse": -7.546063575544875, "cbm_hse": -4.1155025028008065, "alphax_el": 2.2170348941995566, "alphay_el": 2.217034894199554, "alphaz_el": 0.562929358607556, "alphax_lat": 0.8208615580397226, "alphax": 3.0378964522392793, "alphay_lat": 0.8219644123616321, "alphay": 3.0389993065611858, "alphaz_lat": 0.01559561435288263, "alphaz": 0.5785249729604386, "plasmafrequency_x": 0.0, "plasmafrequency_y": 0.0, "cod_id": 1010151, "is_magnetic": true, "spin_axis": "z", "dE_zx": -0.41928945927338646, "dE_zy": -0.4193406617787332, "J": 1.9324016543788711, "lam": 0.03130534028312266, "A": 0.06766229103997527, "spin": 1.5, "N_nn": 3, "ehull": 1.1102230246251565e-16, "hform": -0.8483587702404227}


unique_id: a1ca5b545e2500f91a8b3b31a5815825
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB3/CrBr3/Cr2Br6-b284ac4dcbfe", "uid": "2CrBr3-2", "olduid": "Cr2Br6-5c11c5eaf540", "international": "P-62m", "number": 189, "has_inversion_symmetry": false, "lgnum": 79, "layergroup": "p-62m", "bravais_type": "Hexagonal (hp)", "thickness": 3.2193939611961584, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.22379934328297424, "hform": -0.6245594269574486}


unique_id: 53b2ec0fc9609cc42e6601783807a0f0
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB3/PI3/P2I6-b6808f7e5db1", "uid": "2PI3-1", "olduid": "P2I6-27b3a37bc891", "international": "P-31m", "number": 162, "has_inversion_symmetry": true, "lgnum": 71, "layergroup": "p-31m", "bravais_type": "Hexagonal (hp)", "thickness": 3.250644369543024, "label": "Lyngby22_LDP", "gap": 1.81224084578034, "gap_dir": 1.893167857954953, "gap_dir_nosoc": 2.1015021419586186, "evac": 3.1768105295690643, "efermi": -4.897982959255858, "vbm": -5.804103382146028, "cbm": -3.9918625363656877, "minhessianeig": -1.0142597327471792, "dyn_stab": "No", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.03468822697238183, "hform": -0.029238140945701208}


unique_id: a649b6ea56b9a6a12a8f461a1948d0fb
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB3/RhI3/Rh2I6-cead7a19c832", "uid": "2RhI3-1", "olduid": "Rh2I6-cead7a19c832", "international": "P-31m", "number": 162, "has_inversion_symmetry": true, "lgnum": 71, "layergroup": "p-31m", "bravais_type": "Hexagonal (hp)", "thickness": 3.035707400515906, "label": "original03-18", "gap": 0.9910661198756803, "gap_dir": 1.017603080302179, "gap_dir_nosoc": 1.2891820888045982, "evac": 3.3939750215623032, "efermi": -4.868754452692912, "vbm": -5.364287512630751, "cbm": -4.373221392755071, "minhessianeig": -1.5723179976744326e-15, "dyn_stab": "Yes", "gap_hse": 1.9654730555692967, "gap_dir_hse": 2.024249919337807, "efermi_hse": -5.132530389006177, "vbm_hse": -6.061005751199413, "cbm_hse": -4.095532695630116, "alphax_el": 3.971098410361524, "alphay_el": 3.971098410361526, "alphaz_el": 0.40267177473075627, "alphax_lat": 0.27083296303348886, "alphax": 4.241931373395013, "alphay_lat": 0.2702759383976923, "alphay": 4.241374348759218, "alphaz_lat": 0.015095703191888769, "alphaz": 0.417767477922645, "plasmafrequency_x": 0.0, "plasmafrequency_y": 0.0, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.0, "hform": -0.3129810904719501}


unique_id: f9e58e266e7f685a112d906a2d34cb26
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB3/RhI3/Rh2I6-fc5504debb10", "uid": "2RhI3-2", "olduid": "Rh2I6-fc5504debb10", "international": "P-62m", "number": 189, "has_inversion_symmetry": false, "lgnum": 79, "layergroup": "p-62m", "bravais_type": "Hexagonal (hp)", "thickness": 3.388339104423144, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 3.1793555730791647, "efermi": -4.599438900772437, "minhessianeig": -2.614394834482883, "dyn_stab": "No", "gap_hse": 0.5513728858163094, "gap_dir_hse": 0.6348204109053066, "efermi_hse": -4.795433444699572, "vbm_hse": -4.989395228190661, "cbm_hse": -4.438022342374351, "alphax_el": 19.37127395368014, "alphay_el": 19.371273953680117, "alphaz_el": 0.6695271729739046, "plasmafrequency_x": 2.462065180008864, "plasmafrequency_y": 2.4620651800088647, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.3424441894169492, "hform": 0.0294630989449991}


unique_id: 3bd33896e0b06a40ec3f949297077d89
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB3/AgCl3/Ag2Cl6-f753db8ae919", "uid": "2AgCl3-1", "olduid": "Ag2Cl6-f753db8ae919", "international": "P-31m", "number": 162, "has_inversion_symmetry": true, "lgnum": 71, "layergroup": "p-31m", "bravais_type": "Hexagonal (hp)", "thickness": 2.8508876700678316, "label": "original03-18", "gap": 0.26740472830698625, "gap_dir": 0.26740472929714887, "gap_dir_nosoc": 0.2676756228309696, "evac": 2.6304474805930123, "efermi": -7.18397789837779, "vbm": -7.317680262531283, "cbm": -7.050275534224296, "minhessianeig": -2.1006484815071205e-15, "dyn_stab": "Yes", "gap_hse": 1.2779512687312184, "gap_dir_hse": 1.2779512687626866, "efermi_hse": -7.769078575337993, "vbm_hse": -8.408054209703602, "cbm_hse": -7.1301029409723835, "alphax_el": 3.0171889927229043, "alphay_el": 3.017188992722906, "alphaz_el": 0.32454110217433113, "plasmafrequency_x": 0.0, "plasmafrequency_y": 0.0, "is_magnetic": true, "spin_axis": "y", "dE_zx": 0.033326452921755845, "dE_zy": 0.03394320424376929, "J": 15.68566273116782, "lam": -0.0062900498960516416, "A": -0.014618198974858387, "spin": 1.0, "N_nn": 3, "topology": "Trivial", "ehull": 0.12277646643749218, "hform": -0.15013493763280072}


unique_id: c3bab057f1637cbe92d096996a281403
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB3/AgCl3/Ag2Cl6-5fb64a80cb60", "uid": "2AgCl3-2", "olduid": "Ag2Cl6-5fb64a80cb60", "international": "P6/mmm", "number": 191, "has_inversion_symmetry": true, "lgnum": 80, "layergroup": "p6/mmm", "bravais_type": "Hexagonal (hp)", "thickness": 3.213832903427585, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 2.3480890926961813, "efermi": -7.498142637769055, "minhessianeig": -4.293438143274969, "dyn_stab": "No", "alphax_el": 13.733922817473346, "alphay_el": 13.733922817473331, "alphaz_el": 0.36978435110585733, "plasmafrequency_x": 3.0575340364815085, "plasmafrequency_y": 3.05753403648151, "is_magnetic": true, "spin_axis": "x", "dE_zx": 2.23346289658366, "dE_zy": 2.233457152669871, "J": 14.363477462969362, "lam": -1.6833173884454784, "A": 0.0, "spin": 0.5, "N_nn": 3, "ehull": 0.22898816068686845, "hform": -0.04392324338342446}


unique_id: 6e7dbce3e04e4a7fd26c308606437a1e
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB3/NbF3/Nb2F6-935d0020bb86", "uid": "2NbF3-2", "olduid": "Nb2F6-85953f7645f8", "international": "P-62m", "number": 189, "has_inversion_symmetry": false, "lgnum": 79, "layergroup": "p-62m", "bravais_type": "Hexagonal (hp)", "thickness": 2.6739448753076474, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.25993214053329794, "hform": -2.744791557708486}


unique_id: 5b72e740ea50aada71de9848175850e7
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB3/NbF3/Nb2F6-d27e425c23ff", "uid": "2NbF3-1", "olduid": "Nb2F6-4090db2f8085", "international": "P-31m", "number": 162, "has_inversion_symmetry": true, "lgnum": 71, "layergroup": "p-31m", "bravais_type": "Hexagonal (hp)", "thickness": 2.566947209176143, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.22370823176743393, "hform": -2.78101546647435}


unique_id: 3d2fa4b538a7299ec9af5ce958c3fddf
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB3/CrSe3/Cr2Se6-56f78dcef25b", "uid": "2CrSe3-1", "olduid": "Cr2Se6-16570312a908", "international": "Pmmn", "number": 59, "has_inversion_symmetry": true, "lgnum": 46, "layergroup": "pmmn", "bravais_type": "Rectangular (op)", "thickness": 5.821915518781665, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.09892599592531681, "hform": -0.2654985227446609}


unique_id: 3697a40a130cda1df5ce4ee1a2ff23cb
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB3/TaO3/Ta2O6-61b4edbc0222", "uid": "2TaO3-1", "olduid": "Ta2O6-61b4edbc0222", "international": "Pmmn", "number": 59, "has_inversion_symmetry": true, "lgnum": 46, "layergroup": "pmmn", "bravais_type": "Rectangular (op)", "thickness": 4.419904821101131, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 5.165307307013791, "efermi": -6.6146832849437605, "minhessianeig": -9.991634712423407, "dyn_stab": "No", "alphax_el": 1.8704546777538247, "alphay_el": 2.7733612259875544, "alphaz_el": 0.3969421330310546, "plasmafrequency_x": 0.6682842205243579, "plasmafrequency_y": 14.51623809241964, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.3427466042758027, "hform": -2.1709310940003403}


unique_id: 29711256a6db3a97a43ec22eb2e0cd37
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB3/IrS3/Ir2S6-9de2260d3d9d", "uid": "2IrS3-1", "olduid": "Ir2S6-9de2260d3d9d", "international": "Pc", "number": 7, "has_inversion_symmetry": false, "lgnum": 5, "layergroup": "p11a", "bravais_type": "Oblique (mp)", "thickness": 5.665427825900708, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 4.3200852946221175, "efermi": -5.527687486953063, "minhessianeig": -3.0341317398649817e-15, "dyn_stab": "Yes", "alphax_el": 6.276860333452734, "alphay_el": 10.907790715956502, "alphaz_el": 0.6657202710773913, "plasmafrequency_x": 3.591178289164765, "plasmafrequency_y": 4.68010164652865, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.2131309479229584, "hform": -0.1292451965174033}


unique_id: 7ab9962740ff93237fa9a4c2cb33bb7b
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB3/NiTe3/Ni2Te6-cf941a69797b", "uid": "2NiTe3-3", "olduid": "Ni2Te6-cf941a69797b", "international": "P2_1/m", "number": 11, "has_inversion_symmetry": true, "lgnum": 15, "layergroup": "p2_1/m11", "bravais_type": "Rectangular (op)", "thickness": 6.018475873875517, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 4.54440639745251, "efermi": -4.5151335478800565, "minhessianeig": -2.3582318187458744e-12, "dyn_stab": "Yes", "alphax_el": 36.3168677722016, "alphay_el": 43.691627903266244, "alphaz_el": 0.6969465181638492, "plasmafrequency_x": 8.357023457842807, "plasmafrequency_y": 9.650061909417298, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.15996212633569143, "hform": -0.020422799604133957}


unique_id: ebfaf0a0700c7921da933275320fd57d
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB3/NiTe3/Ni2Te6-263a1a1f1d06", "uid": "2NiTe3-2", "olduid": "Ni2Te6-61e80a7af9c5", "international": "Pmmn", "number": 59, "has_inversion_symmetry": true, "lgnum": 46, "layergroup": "pmmn", "bravais_type": "Rectangular (op)", "thickness": 7.889677344115683, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.12264926256026779, "hform": -0.0577356633795576}


unique_id: e77ea4673475bb0f9c34fd389e83170c
username: cmr
calculator: unknown
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unique_id: 66d07596299ddb8224b78f816a670b31
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
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