# systems

unique_id: 71f7bf514d12ef1b62f5b5ce3b131f38
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABCD2/BrNTeSb2/BrNTeSb2-d4b940d02212", "uid": "1BrNTeSb2-1", "olduid": "BrNTeSb2-bd9e2647e51c", "international": "P1", "number": 1, "has_inversion_symmetry": false, "lgnum": 1, "layergroup": "p1", "bravais_type": "Oblique (mp)", "thickness": 3.9329721796200525, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.3889721893645213, "hform": 0.1627459905797714}


unique_id: 41de2668df22b811822543c0c984f45d
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABCD2/BiClHgS2/Bi2Cl2Hg2S4-a14c7a143461", "uid": "2BiClHgS2-1", "olduid": "Bi2Cl2Hg2S4-6599d642836a", "international": "P2_1/m", "number": 11, "has_inversion_symmetry": true, "lgnum": 15, "layergroup": "p2_1/m11", "bravais_type": "Rectangular (op)", "thickness": 5.904907202679656, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.111504690600482, "hform": -0.3687525268471504}


unique_id: 492b5c4d192979357b33541e1739b552
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/ICSD-COD/4el/Mn4Br4S8Sb4", "uid": "2BrMnSbS2-2", "olduid": "Br2Mn2Sb2S4-5f544d911864", "international": "P2/m", "number": 10, "has_inversion_symmetry": true, "lgnum": 14, "layergroup": "p2/m11", "bravais_type": "Rectangular (op)", "thickness": 4.185719753644451, "label": "exfoliated02-21", "gap": 0.1239968153605111, "gap_dir": 0.1239968153605111, "gap_dir_nosoc": 0.1274096452825768, "evac": 1.6424086039833385, "efermi": -4.328182627535891, "vbm": -4.3901810352161466, "cbm": -4.266184219855635, "minhessianeig": -1.0702576933799457e-13, "dyn_stab": "Yes", "gap_hse": 1.2011865805829927, "gap_dir_hse": 1.2011865805829927, "efermi_hse": -4.599563757293481, "vbm_hse": -5.200157047584978, "cbm_hse": -3.998970467001985, "alphax_el": 5.211464792239429, "alphay_el": 2.7993688572717175, "alphaz_el": 0.4197509036782954, "alphax_lat": 2.477583490690172, "alphax": 7.689048282929601, "alphay_lat": 10.424010552003592, "alphay": 13.22337940927531, "alphaz_lat": 0.031992224810758564, "alphaz": 0.45174312848905396, "cod_id": 1528449, "is_magnetic": true, "spin_axis": "y", "dE_zx": 0.010965321962430608, "dE_zy": 1.1100022902610363, "J": -3.8152081223597634, "lam": -0.0034731891173578333, "A": -0.05068913476407033, "spin": 2.5, "N_nn": 2, "ehull": 0.10198798658248638, "hform": -0.41213614245630126}


unique_id: c2136228b28df65aa67826286e5d9672
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABCD2/BrMnSbS2/Br2Mn2Sb2S4-556139340aa7", "uid": "2BrMnSbS2-1", "olduid": "Br2Mn2Sb2S4-1e307d026f9b", "international": "Pmc2_1", "number": 26, "has_inversion_symmetry": false, "lgnum": 28, "layergroup": "pm2_1b", "bravais_type": "Rectangular (op)", "thickness": 4.176520200493901, "label": "Lyngby22_LDP", "gap": 0.36984200191152494, "gap_dir": 0.3740844165211854, "gap_dir_nosoc": 0.40167403830900694, "evac": 1.6107317945247024, "efermi": -4.472365484013834, "vbm": -4.657286484969596, "cbm": -4.287444483058072, "minhessianeig": -2.9187468540664677e-13, "dyn_stab": "Yes", "gap_hse": 1.629572769052523, "gap_dir_hse": 1.646455031406156, "efermi_hse": -4.8140601208208, "vbm_hse": -5.628846505347061, "cbm_hse": -3.9992737362945383, "is_magnetic": true, "spin_axis": "y", "dE_zx": 0.4152548599449801, "dE_zy": 1.5040239950394607, "J": -3.0296912215089833, "lam": -0.002975044335471466, "A": -0.09184690916299587, "spin": 2.5, "N_nn": 2, "ehull": 0.09551309928344213, "hform": -0.4186110297553455}


unique_id: 8bf58ec3595d5f1b4ea1725beb1dee30
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABCD2/BrSTeTa2/BrSTeTa2-d63fcce07e51", "uid": "1BrSTeTa2-1", "olduid": "BrSTeTa2-ceb9ac52750a", "international": "P3m1", "number": 156, "has_inversion_symmetry": false, "lgnum": 69, "layergroup": "p3m1", "bravais_type": "Hexagonal (hp)", "thickness": 4.32674608798584, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.38271865469072797, "hform": -0.3831305538100601}


unique_id: db45a140c357df9529f963aa15b939aa
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABCD2/AsFFeSe2/As2F2Fe2Se4-60f6fb208ea5", "uid": "2AsFFeSe2-1", "olduid": "As2F2Fe2Se4-2130df2e5e1c", "international": "Pmc2_1", "number": 26, "has_inversion_symmetry": false, "lgnum": 28, "layergroup": "pm2_1b", "bravais_type": "Rectangular (op)", "thickness": 4.04257294057741, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.22047103033474916, "hform": -0.5844973380955707}


unique_id: 5900093805c947cd29175777297ed7d5
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABCD2/BrISSn2/BrISSn2-dc64dda37c1e", "uid": "1BrISSn2-1", "olduid": "BrISSn2-06b9ca6fd2cd", "international": "P3m1", "number": 156, "has_inversion_symmetry": false, "lgnum": 69, "layergroup": "p3m1", "bravais_type": "Hexagonal (hp)", "thickness": 7.214922801432351, "label": "Lyngby22_CDVAE", "gap": 0.9141048458401041, "gap_dir": 1.0397467769791664, "gap_dir_nosoc": 1.0914777498187973, "evac": 4.3115286514395885, "efermi": -5.010480257197185, "vbm": -5.467532680117237, "cbm": -4.553427834277133, "minhessianeig": -0.1956579550925124, "dyn_stab": "No", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.06931515807490811, "hform": -0.5144733603647168}


unique_id: cbb1d4aca28dcef9eed42a70d571d3be
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABCD2/BiClNiSe2/Bi2Cl2Ni2Se4-811dc5a2be6f", "uid": "2BiClNiSe2-1", "olduid": "Bi2Cl2Ni2Se4-052095c6c285", "international": "P2/m", "number": 10, "has_inversion_symmetry": true, "lgnum": 14, "layergroup": "p2/m11", "bravais_type": "Rectangular (op)", "thickness": 3.468011316831266, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.20318340607072072, "hform": -0.3195282167027216}


unique_id: 38c95849d7e3cab5afa5a2eb8fdfe86d
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABCD2/INiSbTe2/I2Ni2Sb2Te4-6a2278523307", "uid": "2INiSbTe2-1", "olduid": "I2Ni2Sb2Te4-84c24f33e452", "international": "P2/m", "number": 10, "has_inversion_symmetry": true, "lgnum": 14, "layergroup": "p2/m11", "bravais_type": "Rectangular (op)", "thickness": 4.534791782270666, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.2210641937011478, "hform": -0.05166470118183497}


unique_id: a2217c70174afc7f395bd64ea94fbc59
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABCD2/ClHgSbS2/Cl2Hg2Sb2S4-0d47c6811d37", "uid": "2ClHgSbS2-1", "olduid": "Cl2Hg2Sb2S4-b81755349f95", "international": "P2_1/m", "number": 11, "has_inversion_symmetry": true, "lgnum": 15, "layergroup": "p2_1/m11", "bravais_type": "Rectangular (op)", "thickness": 6.066240773356748, "label": "Lyngby22_LDP", "gap": 1.374082374212569, "gap_dir": 1.3740823742125738, "gap_dir_nosoc": 1.4040314322076197, "evac": 1.52217751323538, "efermi": -5.465681814893104, "vbm": -6.152723001999389, "cbm": -4.778640627786819, "minhessianeig": -4.083059725124287, "dyn_stab": "No", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.07706553747391665, "hform": -0.3375775217026774}


unique_id: bf99ae44a783c0f6d6f6183213116484
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABCD2/NbSTePd2/Nb2S2Te2Pd4-a54a24e6376d", "uid": "2NbSTePd2-1", "olduid": "Nb2S2Te2Pd4-4e2ad95ba1f1", "international": "Pmma", "number": 51, "has_inversion_symmetry": true, "lgnum": 41, "layergroup": "pmma", "bravais_type": "Rectangular (op)", "thickness": 5.846253054005471, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.133238332455314, "hform": -0.5414822442550132}


unique_id: ad4b5432d228b7cdbb40a209f697a058
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABCD2/ClMnPSe2/Cl2Mn2P2Se4-27959586b81c", "uid": "2ClMnPSe2-1", "olduid": "Cl2Mn2P2Se4-33c912413db7", "international": "Pmc2_1", "number": 26, "has_inversion_symmetry": false, "lgnum": 28, "layergroup": "pm2_1b", "bravais_type": "Rectangular (op)", "thickness": 4.161724144637008, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.14778320073432116, "hform": -0.34412943408776825}


unique_id: dc86b2e9f80b8245032f5ff6155213d0
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABCD2/ClMnPSe2/Cl2Mn2P2Se4-38ffd7161794", "uid": "2ClMnPSe2-2", "olduid": "Cl2Mn2P2Se4-22011daf7c94", "international": "P2/m", "number": 10, "has_inversion_symmetry": true, "lgnum": 14, "layergroup": "p2/m11", "bravais_type": "Rectangular (op)", "thickness": 3.7912660858830645, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.15301846172681355, "hform": -0.33889417309527586}


unique_id: 988db5bc0b974dc05d3e097b68070805
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABCD2/NbSeTePd2/Nb2Se2Te2Pd4-fefe3a40584b", "uid": "2NbSeTePd2-1", "olduid": "Nb2Se2Te2Pd4-94116eada9b5", "international": "Pmma", "number": 51, "has_inversion_symmetry": true, "lgnum": 41, "layergroup": "pmma", "bravais_type": "Rectangular (op)", "thickness": 5.7900417908621336, "label": "Lyngby22_LDP", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 3.053572218968807, "efermi": -4.6275491880217645, "minhessianeig": -1.0338762559454648, "dyn_stab": "No", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.09311010156732635, "hform": -0.4880803626137741}


unique_id: 498467705bec1c53e57102868af56ffe
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABCD2/FFeSbS2/F2Fe2Sb2S4-61bfd52ec4df", "uid": "2FFeSbS2-1", "olduid": "F2Fe2Sb2S4-9bb6bb91a40b", "international": "Pmc2_1", "number": 26, "has_inversion_symmetry": false, "lgnum": 28, "layergroup": "pm2_1b", "bravais_type": "Rectangular (op)", "thickness": 4.06034718172004, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.3112225204891569, "hform": -0.6643030617801173}


unique_id: d46c5876a968c5147dcf9955589e9b00
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABCD2/BiFFeO2/Bi2F2Fe2O4-dfbcb874ef05", "uid": "2BiFFeO2-1", "olduid": "Bi2F2Fe2O4-8c2c0c8990b3", "international": "Pmc2_1", "number": 26, "has_inversion_symmetry": false, "lgnum": 28, "layergroup": "pm2_1b", "bravais_type": "Rectangular (op)", "thickness": 4.467614532995203, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.22390730678902776, "hform": -1.2788145935011201}


unique_id: 10eab54011db6a215302b5104c846826
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABCD2/BiTeTiSe2/BiTeTiSe2-2fba463ed06b", "uid": "1BiTeTiSe2-1", "olduid": "BiTeTiSe2-3a9ad20794f8", "international": "P3m1", "number": 156, "has_inversion_symmetry": false, "lgnum": 69, "layergroup": "p3m1", "bravais_type": "Hexagonal (hp)", "thickness": 4.324660106078628, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.45743064975936865, "hform": -0.2979771754806322}


unique_id: 2b07b9f39d03508a7c7eeb642ab424a7
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABCD2/BrClSSn2/BrClSSn2-9961649dadf1", "uid": "1BrClSSn2-1", "olduid": "BrClSSn2-fd94f511642b", "international": "Cm", "number": 8, "has_inversion_symmetry": false, "lgnum": 13, "layergroup": "cm11", "bravais_type": "Centered rectangular (oc)", "thickness": 6.612192890114915, "label": "Lyngby22_CDVAE", "gap": 1.1831791598845576, "gap_dir": 1.1831791598845576, "gap_dir_nosoc": 1.2344431598144405, "evac": 4.1255163558853125, "efermi": -5.5285520216722, "vbm": -6.120141601614479, "cbm": -4.936962441729921, "minhessianeig": -0.8135922525628941, "dyn_stab": "No", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.03702610776826507, "hform": -0.6887779861488041}


unique_id: 3727f6be84dc850e07dd74550012a311
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABCD2/MnNSbBr2/MnNSbBr2-1cc429f4c20a", "uid": "1MnNSbBr2-1", "olduid": "MnNSbBr2-e85ed302736c", "international": "Pm", "number": 6, "has_inversion_symmetry": false, "lgnum": 4, "layergroup": "p11m", "bravais_type": "Oblique (mp)", "thickness": 3.8749242956261796, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.36032764031108516, "hform": -0.10918521424566094}


unique_id: 40ea12b0a86e37e663c2ab10d5f64a32
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABCD2/AsNbOBr2/AsNbOBr2-58de4199d4c1", "uid": "1AsNbOBr2-1", "olduid": "AsNbOBr2-f2508e26ebc3", "international": "Pm", "number": 6, "has_inversion_symmetry": false, "lgnum": 11, "layergroup": "pm11", "bravais_type": "Rectangular (op)", "thickness": 4.526740607164857, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.37034281980630884, "hform": -0.9573362578576905}


unique_id: ad2f23dae5677151c649e9880add0553
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABCD2/BiINiTe2/Bi2I2Ni2Te4-61ffebad8a6a", "uid": "2BiINiTe2-1", "olduid": "Bi2I2Ni2Te4-dc45c06682d9", "international": "P2/m", "number": 10, "has_inversion_symmetry": true, "lgnum": 14, "layergroup": "p2/m11", "bravais_type": "Rectangular (op)", "thickness": 4.551816845083803, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.24481460588619247, "hform": -0.060845954072423325}


unique_id: 2cd04f1e2decdcc632fc1c074d154d51
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABCD2/AsClSrTe2/As4Cl4Sr4Te8-713620971b89", "uid": "4AsClSrTe2-1", "olduid": "As4Cl4Sr4Te8-e35a7be4adb8", "international": "P2_1/c", "number": 14, "has_inversion_symmetry": true, "lgnum": 17, "layergroup": "p2_1/b11", "bravais_type": "Rectangular (op)", "thickness": 12.354331637502304, "label": "Lyngby22_LDP", "gap": 0.9561091956873579, "gap_dir": 1.2010745566655614, "gap_dir_nosoc": 1.3482799119439557, "evac": 3.3591544961997473, "efermi": -4.752771216409481, "vbm": -5.230825814253159, "cbm": -4.274716618565802, "minhessianeig": -0.017427203642035937, "dyn_stab": "No", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.07877726842777104, "hform": -1.032262941314606}


unique_id: 10a4f5b74272ab2a0133e5498a9820a1
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABCD2/NbSTeCo2/Nb2S2Te2Co4-3cd53f65d41a", "uid": "2NbSTeCo2-1", "olduid": "Nb2S2Te2Co4-0ee8ce12fe94", "international": "Pmma", "number": 51, "has_inversion_symmetry": true, "lgnum": 41, "layergroup": "pmma", "bravais_type": "Rectangular (op)", "thickness": 5.303878079520185, "label": "Lyngby22_LDP", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 3.040570696636969, "efermi": -4.5736761488582705, "minhessianeig": -1.2429731041863432e-12, "dyn_stab": "Yes", "alphax_el": 33.87024044722508, "alphay_el": 49.91696971100365, "alphaz_el": 0.7221216189733759, "plasmafrequency_x": 3.816407383642068, "plasmafrequency_y": 5.6821576680493004, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.017298556611010252, "hform": -0.51664380951391}


unique_id: 4238e26694d97571c75f008608620579
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABCD2/NSSeZn2/NSSeZn2-855068487684", "uid": "1NSSeZn2-1", "olduid": "NSSeZn2-af4ee9cbf574", "international": "P1", "number": 1, "has_inversion_symmetry": false, "lgnum": 1, "layergroup": "p1", "bravais_type": "Oblique (mp)", "thickness": 3.6834498510274285, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.5798380486181325, "hform": -0.039381256367608586}


unique_id: c5bc60d5fb88eae9411503bc4320ad5f
username: cmr
calculator: unknown
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