# systems

unique_id: d9b2d18655810307a3b9257128a3651b
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/AgPTe2/Ag2P2Te4-3e341adb8334", "uid": "2AgPTe2-1", "olduid": "Ag2P2Te4-45c6365311ce", "international": "Pmc2_1", "number": 26, "has_inversion_symmetry": false, "lgnum": 28, "layergroup": "pm2_1b", "bravais_type": "Rectangular (op)", "thickness": 6.17214415218503, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.1787281701629702, "hform": 0.14883162398154415}


unique_id: 48fae31ffb82c474a9cad6fb0ca9c34c
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/ABC2/FNiS2/F2Ni2S4-81a9cf3a07f5", "uid": "2FNiS2-1", "olduid": "F2Ni2S4-81a9cf3a07f5", "international": "P2_1/m", "number": 11, "has_inversion_symmetry": true, "lgnum": 15, "layergroup": "p2_1/m11", "bravais_type": "Rectangular (op)", "thickness": 6.587038274637608, "label": "original03-18", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 4.1156365495097536, "efermi": -5.543577074098388, "minhessianeig": -1.8856034290561254e-15, "dyn_stab": "Yes", "alphax_el": 9.120256857787606, "alphay_el": 4.73130775668848, "alphaz_el": 0.5347978226501308, "plasmafrequency_x": 2.1782891183482374, "plasmafrequency_y": 12.771931086525248, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.09572888760989406, "hform": -0.6710142389057312}


unique_id: fa36bfc6dfe48a0ebc11bcf7da2cfb94
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/FNiS2/F2Ni2S4-8703f99d8627", "uid": "2FNiS2-2", "olduid": "F2Ni2S4-4b6748b1d6ea", "international": "Pm", "number": 6, "has_inversion_symmetry": false, "lgnum": 11, "layergroup": "pm11", "bravais_type": "Rectangular (op)", "thickness": 7.037091446427829, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.19885641877351, "hform": -0.5678867077421152}


unique_id: 93b0a2fdbc3ddbfc46d51a9c7f724d66
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABC2/AlGaSe2/AlGaSe2-c19c2e9a7222", "uid": "1AlGaSe2-1", "olduid": "AlGaSe2-206ba2b10795", "international": "P3m1", "number": 156, "has_inversion_symmetry": false, "lgnum": 69, "layergroup": "p3m1", "bravais_type": "Hexagonal (hp)", "thickness": 4.868869816101643, "label": "Lyngby22_CDVAE", "gap": 2.0494085059487963, "gap_dir": 2.305882621459614, "gap_dir_nosoc": 2.369590573088893, "evac": 3.812694570335549, "efermi": -4.762592261451538, "vbm": -5.787296514425937, "cbm": -3.7378880084771406, "minhessianeig": 6.1251559373075e-16, "dyn_stab": "Yes", "gap_hse": 2.7649997447176933, "gap_dir_hse": 3.1054979593600103, "efermi_hse": -4.885849034328661, "vbm_hse": -6.268348906687507, "cbm_hse": -3.503349161969814, "alphax_el": 3.9269759889363436, "alphay_el": 3.925332788932522, "alphaz_el": 0.5203186321435438, "alphax_lat": 1.9248315724007368, "alphax": 5.851807561337081, "alphay_lat": 1.9203570500152405, "alphay": 5.845689838947763, "alphaz_lat": 0.019015190494067868, "alphaz": 0.5393338226376116, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.021591474588595116, "hform": -0.6641784866022462}


unique_id: 7625764711ca8cb2be24c24f41edc9d2
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABC2/HfNCl2/HfNCl2-db78fbee8235", "uid": "1HfNCl2-1", "olduid": "HfNCl2-effa768029d8", "international": "Pmm2", "number": 25, "has_inversion_symmetry": false, "lgnum": 27, "layergroup": "pm2m", "bravais_type": "Rectangular (op)", "thickness": 3.5333625722182873, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.699298688753474, "hform": -0.9973584336188575}


unique_id: bd91020714520b1037b1c13f6e26fc69
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/FeHSe2/Fe2H2Se4-0905765df7e4", "uid": "2FeHSe2-1", "olduid": "Fe2H2Se4-5b0466e0ca57", "international": "P2_1/m", "number": 11, "has_inversion_symmetry": true, "lgnum": 15, "layergroup": "p2_1/m11", "bravais_type": "Rectangular (op)", "thickness": 6.642564380886147, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.1640745334513803, "hform": -0.10595281687596625}


unique_id: 4602d76326fc4f08cd37124c1afcc8fa
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABC2/OSbBr2/OSbBr2-b26d545ccccc", "uid": "1OSbBr2-1", "olduid": "OSbBr2-d2658dc8ea98", "international": "Pmmm", "number": 47, "has_inversion_symmetry": true, "lgnum": 37, "layergroup": "pmmm", "bravais_type": "Rectangular (op)", "thickness": 3.957917707775014, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.14544520837991737, "hform": -0.7030162427936042}


unique_id: 90186ab6b1cd555886cbfb46e74ab2be
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABC2/NiTaS2/NiTaS2-94762eac5b38", "uid": "1NiTaS2-1", "olduid": "NiTaS2-1e8a0868e943", "international": "P-4m2", "number": 115, "has_inversion_symmetry": false, "lgnum": 59, "layergroup": "p-4m2", "bravais_type": "Square (tp)", "thickness": 2.8646189915720726, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.23241890086645633, "hform": -0.6219539206746063}


unique_id: 769a9c63b430f44db34e50b9e204b492
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/CoFSe2/Co2F2Se4-a62f22ea0193", "uid": "2CoFSe2-1", "olduid": "Co2F2Se4-8877f591b577", "international": "P2_1/m", "number": 11, "has_inversion_symmetry": true, "lgnum": 15, "layergroup": "p2_1/m11", "bravais_type": "Rectangular (op)", "thickness": 6.6629888521174445, "label": "Lyngby22_LDP", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 4.82451791334872, "efermi": -5.764700059490671, "minhessianeig": -8.615523796562134e-14, "dyn_stab": "Yes", "alphax_el": 15.327996400330358, "alphay_el": 28.86188789855249, "alphaz_el": 0.6282793999686819, "plasmafrequency_x": 3.5204997335948938, "plasmafrequency_y": 6.601847234805221, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.08055575683771088, "hform": -0.7123168633765058}


unique_id: 88fb2a120c24afe07747662383eff6bb
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/ICSD-COD/3el/Na4O8S4", "uid": "4NaSO2-1", "olduid": "Na4S4O8-e2c84479ddc3", "international": "P2/c", "number": 13, "has_inversion_symmetry": true, "lgnum": 7, "layergroup": "p112/a", "bravais_type": "Oblique (mp)", "thickness": 4.606018908733901, "label": "exfoliated02-21", "gap": 2.384531204581524, "gap_dir": 2.38554777207505, "gap_dir_nosoc": 2.3856481382247114, "evac": 1.3878696484920068, "efermi": -3.5650415717992034, "vbm": -4.7573071740899655, "cbm": -2.3727759695084414, "minhessianeig": -0.05295247347209886, "dyn_stab": "No", "cod_id": 2310568, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.14019338887027577, "hform": -1.4708969014098896}


unique_id: d96a8dea7152a285d9390ca4cd79f150
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABC2/CuNBr2/CuNBr2-001b1d9b1706", "uid": "1CuNBr2-1", "olduid": "CuNBr2-32fd5ea1bb87", "international": "P1", "number": 1, "has_inversion_symmetry": false, "lgnum": 1, "layergroup": "p1", "bravais_type": "Oblique (mp)", "thickness": 3.5750382992173746, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.7878944208330829, "hform": 0.5448894962134232}


unique_id: 99a3adfd9b6cecaab488371790adc7a5
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/BiNaO2/Bi4Na4O8-85892a6c3404", "uid": "4BiNaO2-1", "olduid": "Bi4Na4O8-2e63003e4006", "international": "Pbcm", "number": 57, "has_inversion_symmetry": true, "lgnum": 45, "layergroup": "pbma", "bravais_type": "Rectangular (op)", "thickness": 6.440087996272853, "label": "Lyngby22_LDP", "gap": 2.60157386572106, "gap_dir": 2.614345852947472, "gap_dir_nosoc": 3.0120532692536477, "evac": 1.9732941767255263, "efermi": -3.5449754322640104, "vbm": -4.84576236512454, "cbm": -2.24418849940348, "minhessianeig": -8.879512773474077e-14, "dyn_stab": "Yes", "gap_hse": 3.9474777496566107, "gap_dir_hse": 3.9474777496566116, "efermi_hse": -3.9571907687836436, "vbm_hse": -5.9309296436119485, "cbm_hse": -1.9834518939553385, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.0, "hform": -1.4100405860548175}


unique_id: 983c7ccca3399ea696b8f6988fac709c
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/CsTiTe2/CsTiTe2-840af12c630a", "uid": "1CsTiTe2-1", "olduid": "CsTiTe2-f03ab093a212", "international": "P3m1", "number": 156, "has_inversion_symmetry": false, "lgnum": 69, "layergroup": "p3m1", "bravais_type": "Hexagonal (hp)", "thickness": 5.836314202015991, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.3066060410674266, "hform": -0.5520664493877341}


unique_id: 61c22cddd06465f7b8774615de30694c
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/CsTiO2/CsTiO2-cbd3d6525cd4", "uid": "1CsTiO2-1", "olduid": "CsTiO2-b782655e9481", "international": "P3m1", "number": 156, "has_inversion_symmetry": false, "lgnum": 69, "layergroup": "p3m1", "bravais_type": "Hexagonal (hp)", "thickness": 4.007372789900121, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.466480806838101, "hform": -1.8440314774132833}


unique_id: bd433977d017d4a1d2e2d53fee50e80c
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABC2/MoSeI2/MoSeI2-13f4896e73c1", "uid": "1MoSeI2-1", "olduid": "MoSeI2-1b7d57483dad", "international": "Pmmm", "number": 47, "has_inversion_symmetry": true, "lgnum": 37, "layergroup": "pmmm", "bravais_type": "Rectangular (op)", "thickness": 3.973651079725631, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.30201146255530736, "hform": -0.11927575196339824}


unique_id: 6c008e62d7a49c84e0c1fd65d2021ac5
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/RuSBr2/RuSBr2-0d550916e5e0", "uid": "1RuSBr2-1", "olduid": "RuSBr2-6f1def23ece2", "international": "Pmmm", "number": 47, "has_inversion_symmetry": true, "lgnum": 37, "layergroup": "pmmm", "bravais_type": "Rectangular (op)", "thickness": 3.4790477588664874, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.20721408017559745, "hform": -0.16841974950187488}


unique_id: 987fb7672282a0683e192920862e6004
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABC2/AlNiSe2/AlNiSe2-d3241ef73d22", "uid": "1AlNiSe2-1", "olduid": "AlNiSe2-52720e20d57c", "international": "P3m1", "number": 156, "has_inversion_symmetry": false, "lgnum": 69, "layergroup": "p3m1", "bravais_type": "Hexagonal (hp)", "thickness": 3.590571586803975, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.1335220199960021, "hform": -0.4907077663982973}


unique_id: 5f906c6711c8e131783339bb5c32da25
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_Wang23/ABC2/AlHSe2/Al2H2Se4-fcef85c6e31d", "uid": "2AlHSe2-1", "olduid": "Al2H2Se4-540a3aab2d5c", "international": "P2_1/m", "number": 11, "has_inversion_symmetry": true, "lgnum": 15, "layergroup": "p2_1/m11", "bravais_type": "Rectangular (op)", "thickness": 6.3645473499015015, "label": "Wang23", "gap": 1.3451161417472535, "gap_dir": 1.3451161417472535, "gap_dir_nosoc": 1.3532782069218303, "evac": 3.5202814197092054, "efermi": -4.3298335253820905, "vbm": -5.002391596255718, "cbm": -3.657275454508464, "minhessianeig": -1.5246346282157133e-12, "dyn_stab": "Unknown", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.013385503668582377, "hform": -0.5220838558804699}


unique_id: 6fbfcec2b2c993569837ad921556d405
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABC2/NZnF2/NZnF2-e178248338e5", "uid": "1NZnF2-1", "olduid": "NZnF2-4f6271ae4eca", "international": "P4/mmm", "number": 123, "has_inversion_symmetry": true, "lgnum": 61, "layergroup": "p4/mmm", "bravais_type": "Square (tp)", "thickness": 3.5505563386881676, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 1.7704721265845222, "hform": -0.03747353865531533}


unique_id: d9ad8492100471818e964b31a0551647
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/ICSD-COD/3el/Nb4Br8O4", "uid": "2NbOBr2-1", "olduid": "Nb2O2Br4-7d127da2c220", "international": "Pmm2", "number": 25, "has_inversion_symmetry": false, "lgnum": 27, "layergroup": "pm2m", "bravais_type": "Rectangular (op)", "thickness": 4.199604355664482, "label": "exfoliated02-21", "gap": 1.0381789909084982, "gap_dir": 1.1870239189078142, "gap_dir_nosoc": 1.191645370793088, "evac": 1.8136080930410958, "efermi": -5.13012866192465, "vbm": -5.6492181573788995, "cbm": -4.611039166470401, "minhessianeig": -2.22494887629248e-15, "dyn_stab": "Yes", "gap_hse": 1.922832307406365, "gap_dir_hse": 2.0731744026448204, "efermi_hse": -4.98920841661533, "vbm_hse": -5.950624570318513, "cbm_hse": -4.027792262912148, "alphax_el": 1.8437482236461407, "alphay_el": 2.8844654734571953, "alphaz_el": 0.3902648396155566, "alphax_lat": 2.7250164436071915, "alphax": 4.568764667253332, "alphay_lat": 2.3755500890080326, "alphay": 5.260015562465227, "alphaz_lat": 0.022588707867150008, "alphaz": 0.4128535474827066, "icsd_id": 416669, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "is_ferroelectric": true, "P_spontaneous_norm": 199.31867277259585, "ehull": 2.220446049250313e-16, "hform": -1.659598847079999}


unique_id: 95122fc5b1811c0cd6bd25bb0a2d8c87
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABC2/AgSeBr2/AgSeBr2-915c50912461", "uid": "1AgSeBr2-1", "olduid": "AgSeBr2-3aa32a914793", "international": "Pmm2", "number": 25, "has_inversion_symmetry": false, "lgnum": 23, "layergroup": "pmm2", "bravais_type": "Rectangular (op)", "thickness": 5.456180900246629, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.2507055793630071, "hform": 0.02822690917903703}


unique_id: 86adb7c6b23b6831a1221942620a4da3
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABC2/AuSrBr2/AuSrBr2-1856ffc51755", "uid": "1AuSrBr2-1", "olduid": "AuSrBr2-71a527536a86", "international": "P1", "number": 1, "has_inversion_symmetry": false, "lgnum": 1, "layergroup": "p1", "bravais_type": "Oblique (mp)", "thickness": 3.5462048200341405, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.4413491211618985, "hform": -1.1881778467900315}


unique_id: 41d3815714085021f3f53237983afd33
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/CrOCl2/CrOCl2-1381b6c39e7a", "uid": "1CrOCl2-1", "olduid": "CrOCl2-0be486177c39", "international": "Pmmm", "number": 47, "has_inversion_symmetry": true, "lgnum": 37, "layergroup": "pmmm", "bravais_type": "Rectangular (op)", "thickness": 3.2749516801951, "label": "Lyngby22_LDP", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 1.661805402695626, "efermi": -6.183386237161168, "dyn_stab": "Unknown", "is_magnetic": true, "spin_axis": "y", "dE_zx": -0.04731242808020397, "dE_zy": 0.08186589587921844, "ehull": 0.0415756094495463, "hform": -1.2406315327912907}


unique_id: a9902ec28bc6ddd1b59100faf7864a5e
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/BiCuO2/Bi2Cu2O4-5e8529c60f48", "uid": "2BiCuO2-1", "olduid": "Bi2Cu2O4-c4752fb36f8a", "international": "Pmma", "number": 51, "has_inversion_symmetry": true, "lgnum": 41, "layergroup": "pmma", "bravais_type": "Rectangular (op)", "thickness": 5.123646839022193, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.23289650715922228, "hform": -0.6910383062210448}


unique_id: 215a02f46e1981d79eba76bab4b005d8
username: cmr
calculator: unknown
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