# systems

unique_id: 5c46a4436ad6f67642eaaa2a713b6b97
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB3/NbTe3/Nb2Te6-888e5c111620", "uid": "2NbTe3-1", "olduid": "Nb2Te6-888e5c111620", "international": "Pmmn", "number": 59, "has_inversion_symmetry": true, "lgnum": 46, "layergroup": "pmmn", "bravais_type": "Rectangular (op)", "thickness": 6.693327549269281, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 5.635212612705957, "efermi": -4.2788193518353665, "minhessianeig": -0.03455737213322694, "dyn_stab": "No", "alphax_el": 184.27849286572692, "alphay_el": 42.7458474382643, "alphaz_el": 0.7345730810009203, "plasmafrequency_x": 6.000623252636236, "plasmafrequency_y": 13.669918435471502, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.06469006152739265, "hform": -0.31433817219061577}


unique_id: adf560923a56715032c84dd522306a67
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB3/MnSe3/Mn2Se6-2ef1630aae37", "uid": "2MnSe3-1", "olduid": "Mn2Se6-234b082eb4aa", "international": "P2_1/m", "number": 11, "has_inversion_symmetry": true, "lgnum": 15, "layergroup": "p2_1/m11", "bravais_type": "Rectangular (op)", "thickness": 6.216670264724644, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.16384351030101024, "hform": -0.18810287954425853}


unique_id: 67d9e0b1496465fd3791c29dceedb208
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB3/SbCl3/Sb2Cl6-b7baa86cd4cd", "uid": "2SbCl3-1", "olduid": "Sb2Cl6-50d6bbdac5b8", "international": "P-31m", "number": 162, "has_inversion_symmetry": true, "lgnum": 71, "layergroup": "p-31m", "bravais_type": "Hexagonal (hp)", "thickness": 3.0745097406915862, "label": "Lyngby22_LDP", "gap": 2.6467294446383947, "gap_dir": 2.6561684735050624, "gap_dir_nosoc": 2.7845246000972477, "evac": 2.600912622278536, "efermi": -5.934332632696783, "vbm": -7.257697355015981, "cbm": -4.610967910377586, "minhessianeig": -2.379077356306495, "dyn_stab": "No", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.022984838211477232, "hform": -0.8655000001711839}


unique_id: ae3442e30136912819af45a9cfb3736b
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB3/NB3/N2B6-c1169b08f74d", "uid": "2NB3-1", "olduid": "N2B6-9e96fb053658", "international": "P6/mmm", "number": 191, "has_inversion_symmetry": true, "lgnum": 80, "layergroup": "p6/mmm", "bravais_type": "Hexagonal (hp)", "thickness": 5.957403459433408e-10, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.8187933920207339, "hform": 0.17270637491955032}


unique_id: 23c4a3eddd9fb561e1dbc1017d993c0d
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB3/MoH3/Mo2H6-cc06d6061818", "uid": "2MoH3-1", "olduid": "Mo2H6-b7963515ae80", "international": "P2_1/m", "number": 11, "has_inversion_symmetry": true, "lgnum": 15, "layergroup": "p2_1/m11", "bravais_type": "Rectangular (op)", "thickness": 4.143217630132673, "label": "Lyngby22_LDP", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 2.309340224484859, "efermi": -5.487513459635063, "minhessianeig": -5.208699249881179e-13, "dyn_stab": "Yes", "alphax_el": 6.231166116725176, "alphay_el": 14.398479284287117, "alphaz_el": 0.3793455608361352, "plasmafrequency_x": 7.51295020859414, "plasmafrequency_y": 7.698879533202705, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.08583338798066009, "hform": 0.08583338798066009}


unique_id: e3e5fcfb1e748e7564bee7fb06435e3c
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB3/ScI3/Sc2I6-0a5d381b331c", "uid": "2ScI3-1", "olduid": "Sc2I6-0a5d381b331c", "international": "P-31m", "number": 162, "has_inversion_symmetry": true, "lgnum": 71, "layergroup": "p-31m", "bravais_type": "Hexagonal (hp)", "thickness": 3.363030917397312, "label": "original03-18", "gap": 1.851038953349716, "gap_dir": 2.050008308924402, "gap_dir_nosoc": 2.346850452065932, "evac": 3.066192881682128, "efermi": -5.002019736818908, "vbm": -5.927539213493766, "cbm": -4.07650026014405, "minhessianeig": -1.6844341226903274e-15, "dyn_stab": "Yes", "gap_hse": 3.428145319428472, "gap_dir_hse": 3.7239771952566376, "efermi_hse": -4.536662001412182, "vbm_hse": -6.478804459335513, "cbm_hse": -3.050659139907041, "alphax_el": 2.051706463612285, "alphay_el": 2.0517064636122893, "alphaz_el": 0.3916894528106873, "alphax_lat": 2.972661514720988, "alphax": 5.024367978333273, "alphay_lat": 2.9691773947977107, "alphay": 5.02088385841, "alphaz_lat": 0.03449051380114141, "alphaz": 0.4261799666118287, "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": -1.2885788027682175}


unique_id: f6a7853cb7891873fe13b31aee3e6067
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB3/ScI3/Sc2I6-d59c550c4a3a", "uid": "2ScI3-4", "olduid": "Sc2I6-d59c550c4a3a", "international": "P-62m", "number": 189, "has_inversion_symmetry": false, "lgnum": 79, "layergroup": "p-62m", "bravais_type": "Hexagonal (hp)", "thickness": 3.70998759284162, "label": "original03-18", "gap": 1.8629343433650283, "gap_dir": 1.9559675201604756, "gap_dir_nosoc": 2.08489133879376, "evac": 2.886300800563767, "efermi": -5.126628756027049, "vbm": -6.058095927709564, "cbm": -4.195161584344535, "minhessianeig": -0.01704780951557376, "dyn_stab": "No", "alphax_el": 1.7504175599657035, "alphay_el": 1.7504175599657026, "alphaz_el": 0.4073258599395003, "plasmafrequency_x": 0.0, "plasmafrequency_y": 0.0, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.09174507722155711, "hform": -1.1968337255466603}


unique_id: 70b49c54201100b3000776becb7e7bcc
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_Wang23/AB3/ScI3/Sc2I6-d9df3f5ebf85", "uid": "2ScI3-3", "olduid": "Sc2I6-e136a72c5cd2", "international": "Pmmm", "number": 47, "has_inversion_symmetry": true, "lgnum": 37, "layergroup": "pmmm", "bravais_type": "Rectangular (op)", "thickness": 4.069907980809353, "label": "Wang23", "gap": 1.1516885958407532, "gap_dir": 1.1516885958407532, "gap_dir_nosoc": 1.3805281895215893, "evac": 2.858986223452084, "efermi": -5.037712139586788, "vbm": -5.613556437507166, "cbm": -4.461867841666412, "minhessianeig": -0.20012994939825204, "dyn_stab": "No", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.07650600180485201, "hform": -1.2120728009633654}


unique_id: 1ec24d365f9eea1b9477ff8ad5601eb3
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_Wang23/AB3/ScI3/Sc2I6-04dcbb56bb5e", "uid": "2ScI3-2", "olduid": "Sc2I6-a3a1586d1c5e", "international": "Pmma", "number": 51, "has_inversion_symmetry": true, "lgnum": 41, "layergroup": "pmma", "bravais_type": "Rectangular (op)", "thickness": 3.8336924413408955, "label": "Wang23", "gap": 1.0733028864296725, "gap_dir": 1.0733028864296725, "gap_dir_nosoc": 1.3605294580165517, "evac": 3.099824189861396, "efermi": -4.994152486503813, "vbm": -5.530803929718649, "cbm": -4.457501043288977, "minhessianeig": -3.645133504231021e-13, "dyn_stab": "Yes", "gap_hse": 2.6277931306556495, "gap_dir_hse": 2.6277931306556495, "efermi_hse": -4.777322091068685, "vbm_hse": -6.09121865639651, "cbm_hse": -3.46342552574086, "alphax_el": 2.5407857398448517, "alphay_el": 2.5626489790681797, "alphaz_el": 0.40102437058389045, "alphax_lat": 11.991016820844983, "alphax": 14.531802560689835, "alphay_lat": 5.211041159064498, "alphay": 7.773690138132678, "alphaz_lat": 0.03493882465466968, "alphaz": 0.43596319523856014, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.04695923260414103, "hform": -1.2416195701640764}


unique_id: f9c06c9cdb5414c461fcd2f9ac76c3c9
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB3/SnTe3/Sn2Te6-3dee5c954078", "uid": "2SnTe3-1", "olduid": "Sn2Te6-e98219e888c8", "international": "P2_1", "number": 4, "has_inversion_symmetry": false, "lgnum": 9, "layergroup": "p2_111", "bravais_type": "Rectangular (op)", "thickness": 6.796262295859252, "label": "Lyngby22_LDP", "gap": 0.14755193169050837, "gap_dir": 0.2660170694207745, "gap_dir_nosoc": 0.37587885894843676, "evac": 4.422545449411605, "efermi": -4.71984443433101, "vbm": -4.793620400176265, "cbm": -4.6460684684857565, "minhessianeig": -8.662485585533479e-16, "dyn_stab": "Yes", "gap_hse": 0.3461436278468629, "gap_dir_hse": 0.43891530846727544, "efermi_hse": -4.7716806997748265, "vbm_hse": -4.944752513698258, "cbm_hse": -4.598608885851395, "alphax_el": 34.54392791213172, "alphay_el": 17.82837703193418, "alphaz_el": 0.729454271939625, "alphax_lat": 21.347550876260073, "alphax": 55.891478788391794, "alphay_lat": 14.722201349710279, "alphay": 32.550578381644456, "alphaz_lat": 0.020419209284490727, "alphaz": 0.7498734812241157, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.09600647407139973, "hform": -0.043140992717840554}


unique_id: 4410e58f7fc4d10d350ebacfc4253f5f
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB3/SnTe3/Sn2Te6-b381de205b19", "uid": "2SnTe3-2", "olduid": "Sn2Te6-73ad3aacf2ef", "international": "P2_1", "number": 4, "has_inversion_symmetry": false, "lgnum": 9, "layergroup": "p2_111", "bravais_type": "Rectangular (op)", "thickness": 7.478165059532866, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.11452661955551124, "hform": -0.024620847233729037}


unique_id: df1da441ae367d83b1d98f3607f2a214
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/elrashidy24-tree/AB3/MnF3/MnF3-a8ba3b1cbb78", "uid": "1MnF3-1", "international": "Pmmm", "number": 47, "has_inversion_symmetry": true, "lgnum": 37, "layergroup": "pmmm", "thickness": 2.4715985289314055, "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 1.1580924314132282, "efermi": -6.995381541318798, "dyn_stab": "Unknown", "is_magnetic": true, "spin_axis": "z", "dE_zx": -0.11286174753877276, "dE_zy": -0.22408067411561206, "ehull": 0.006522405852066537, "hform": -2.4752007737589197}


unique_id: f8886ebdc1cabfb531a53fb159ab500b
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB3/CrTe3/Cr2Te6-e31ef1fbdf8c", "uid": "2CrTe3-1", "olduid": "Cr2Te6-e31ef1fbdf8c", "international": "P2_1/m", "number": 11, "has_inversion_symmetry": true, "lgnum": 15, "layergroup": "p2_1/m11", "bravais_type": "Rectangular (op)", "thickness": 6.7723404660628175, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 5.119018359764448, "efermi": -4.8290086512926536, "minhessianeig": -1.8459087136884965e-13, "dyn_stab": "No", "alphax_el": 45.61248804556006, "alphay_el": 40.995196895777006, "alphaz_el": 1.1304438044704894, "plasmafrequency_x": 5.854642207263877, "plasmafrequency_y": 12.58570237200964, "is_magnetic": true, "spin_axis": "z", "dE_zx": -1.7128428416128827, "dE_zy": -0.6424610664907959, "J": 5.634093367092419, "lam": -0.11745688398079324, "A": 1.956605020879465, "spin": 1.0, "N_nn": 4, "ehull": 0.09915126143614389, "hform": -0.06134174103901646}


unique_id: 3773e78b5b228b396dff4acc2433c3c6
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB3/CrTe3/Cr2Te6-3e702c523d31", "uid": "2CrTe3-2", "olduid": "Cr2Te6-338eb9720df9", "international": "Pmmn", "number": 59, "has_inversion_symmetry": true, "lgnum": 46, "layergroup": "pmmn", "bravais_type": "Rectangular (op)", "thickness": 6.226308574542449, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.12675445457025086, "hform": -0.03373854790490949}


unique_id: efa7b4aa821bde004f419aaf15895e55
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB3/BiSn3/Bi2Sn6-6bd3b76ad787", "uid": "2BiSn3-1", "olduid": "Bi2Sn6-6bd3b76ad787", "international": "P6/mmm", "number": 191, "has_inversion_symmetry": true, "lgnum": 80, "layergroup": "p6/mmm", "bravais_type": "Hexagonal (hp)", "thickness": 8.203358348168877e-08, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 2.115589990659406, "efermi": -4.549826496680327, "minhessianeig": -2.1685360961314752, "dyn_stab": "No", "plasmafrequency_x": 5.955332064341922, "plasmafrequency_y": 6.035091446554836, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.6480606120420132, "hform": 0.6480606120420132}


unique_id: 738299be8ada0687937eb4aebc41b6f3
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/AB3/FeTe3/Fe2Te6-71c01b5ce715", "uid": "2FeTe3-2", "olduid": "Fe2Te6-71c01b5ce715", "international": "P2_1/m", "number": 11, "has_inversion_symmetry": true, "lgnum": 15, "layergroup": "p2_1/m11", "bravais_type": "Rectangular (op)", "thickness": 6.337988640699689, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 5.3175618262838, "efermi": -4.664876965249133, "minhessianeig": -0.7762368024188643, "dyn_stab": "No", "alphax_el": 282.5532708410324, "alphay_el": 64.59258187975333, "alphaz_el": 0.7874767934723023, "plasmafrequency_x": 3.8501870068660224, "plasmafrequency_y": 8.928331765797312, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.2151522809168371, "hform": 0.07020774049679357}


unique_id: 5e7f17b8159137b08339c54fb42d090b
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB3/FeTe3/Fe2Te6-8d2d669b42ba", "uid": "2FeTe3-1", "olduid": "Fe2Te6-66473ba2a358", "international": "P2_1/m", "number": 11, "has_inversion_symmetry": true, "lgnum": 15, "layergroup": "p2_1/m11", "bravais_type": "Rectangular (op)", "thickness": 7.332167586684612, "label": "Lyngby22_LDP", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 4.835820042871084, "efermi": -4.330879076593456, "dyn_stab": "Unknown", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.16926347355911628, "hform": 0.02431893313907274}


unique_id: a7dfd4cc39f899a78d9153ad914e1c1e
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_Wang23/AB3/AgI3/Ag4I12-289dd8610f00", "uid": "4AgI3-1", "olduid": "Ag4I12-b270ba89e948", "international": "Cmme", "number": 67, "has_inversion_symmetry": true, "lgnum": 48, "layergroup": "cmme", "bravais_type": "Centered rectangular (oc)", "thickness": 4.22693626337632, "label": "Wang23", "gap": 0.8430542563581698, "gap_dir": 0.8950924887529088, "gap_dir_nosoc": 0.9394951410945966, "evac": 3.2780193851417962, "efermi": -5.387284583648301, "vbm": -5.808811711827387, "cbm": -4.965757455469216, "minhessianeig": -0.2812546380920173, "dyn_stab": "No", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.039813535727243554, "hform": -0.09464210223874603}


unique_id: de3ecbf424d4d74da61254266cd699dc
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/AB3/InF3/In2F6-1f7ff4a53bb9", "uid": "2InF3-3", "olduid": "In2F6-3e219787fc1d", "international": "P6/mmm", "number": 191, "has_inversion_symmetry": true, "lgnum": 80, "layergroup": "p6/mmm", "bravais_type": "Hexagonal (hp)", "thickness": 2.5299671562637984, "label": "Lyngby22_LDP", "gap": 4.548954717530801, "gap_dir": 4.587525225469349, "gap_dir_nosoc": 4.593141316143373, "evac": 2.1320677918881428, "efermi": -7.9567001296408, "vbm": -10.2311774884062, "cbm": -5.6822227708754, "minhessianeig": -0.6937030088506002, "dyn_stab": "No", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.09208436640722795, "hform": -2.535049504969245}


unique_id: 163555a3f403a87faacf5be87c974508
username: cmr
calculator: unknown
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unique_id: e7d218f8b3394acce1d80cf0cd353591
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC3/AsSiTe3/As2Si2Te6-2de741ed9b4f", "uid": "2AsSiTe3-1", "olduid": "As2Si2Te6-6d6a6b7d4b4a", "international": "P-31m", "number": 162, "has_inversion_symmetry": true, "lgnum": 71, "layergroup": "p-31m", "bravais_type": "Hexagonal (hp)", "thickness": 3.6502931724336474, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.18534932999482318, "hform": 0.14550235457174027}


