# systems

unique_id: 4a5b1c1dae1d3103160b15bac6ba7ea5
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABC2/CdHfTe2/CdHfTe2-6622470739b5", "uid": "1CdHfTe2-1", "olduid": "CdHfTe2-f60da790f107", "international": "P3m1", "number": 156, "has_inversion_symmetry": false, "lgnum": 69, "layergroup": "p3m1", "bravais_type": "Hexagonal (hp)", "thickness": 4.723068772908185, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.43057659377944457, "hform": -0.19263267885126467}


unique_id: 4aa9623763cc66195fd1fbe6ff7e9f3b
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/BGeF2/BGeF2-0b90ad173915", "uid": "1BGeF2-1", "olduid": "BGeF2-542378805648", "international": "P3m1", "number": 156, "has_inversion_symmetry": false, "lgnum": 69, "layergroup": "p3m1", "bravais_type": "Hexagonal (hp)", "thickness": 3.927691450581926, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.5090307445388973, "hform": -1.3891709331076654}


unique_id: ef0c00c39a465123eaf45331d761bb86
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/LiTeS2/Li4Te4S8-0cc69cdea36b", "uid": "4LiTeS2-1", "olduid": "Li4Te4S8-93fefd0bedcf", "international": "P2/c", "number": 13, "has_inversion_symmetry": true, "lgnum": 7, "layergroup": "p112/a", "bravais_type": "Oblique (mp)", "thickness": 6.701846047154133, "label": "Lyngby22_LDP", "gap": 0.3514535984286633, "gap_dir": 0.35145359842866375, "gap_dir_nosoc": 0.36723821834005843, "evac": 2.1750028704392395, "efermi": -4.311062218279751, "vbm": -4.486789017494083, "cbm": -4.13533541906542, "minhessianeig": -0.56563348488395, "dyn_stab": "No", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.087679400498608, "hform": -0.4429074076986068}


unique_id: 747c8e5e646876435b0d82d01b1fd753
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABC2/InSiTe2/InSiTe2-8dd31af574c4", "uid": "1InSiTe2-1", "olduid": "InSiTe2-695f56393fa8", "international": "Pm", "number": 6, "has_inversion_symmetry": false, "lgnum": 11, "layergroup": "pm11", "bravais_type": "Rectangular (op)", "thickness": 3.238278936989431, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.26657851323480836, "hform": 0.04053939562938469}


unique_id: 97725d63352c5fc5b1bfd75ed79efed8
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABC2/ClScBr2/Cl2Sc2Br4-6850dfcc71eb", "uid": "2ClScBr2-1", "olduid": "Cl2Sc2Br4-b7cdfa4b3196", "international": "Cm", "number": 8, "has_inversion_symmetry": false, "lgnum": 13, "layergroup": "cm11", "bravais_type": "Centered rectangular (oc)", "thickness": 3.1353011798307655, "label": "Lyngby22_CDVAE", "gap": 3.0674273891359602, "gap_dir": 3.2334664353377542, "gap_dir_nosoc": 3.2871903972718766, "evac": 2.693686886347716, "efermi": -5.735601361447637, "vbm": -7.269315056015618, "cbm": -4.2018876668796565, "minhessianeig": -3.599874745367079e-15, "dyn_stab": "Yes", "gap_hse": 4.935391666345325, "gap_dir_hse": 5.150781242202919, "efermi_hse": -5.584079367434848, "vbm_hse": -8.05177520060751, "cbm_hse": -3.1163835342621864, "alphax_el": 1.2613655866185889, "alphay_el": 1.322323757817899, "alphaz_el": 0.3209747861143686, "alphax_lat": 2.463656606983537, "alphax": 3.725022193602126, "alphay_lat": 2.648010128528759, "alphay": 3.970333886346658, "alphaz_lat": 0.04604002138616228, "alphaz": 0.36701480750053084, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.0, "hform": -1.908145925721736}


unique_id: a63bb9cec0390daa45bd59d410b0365f
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree/ABC2/AgISe2/Ag2I2Se4-5480bc670f81", "uid": "2AgISe2-1", "olduid": "Ag2I2Se4-5480bc670f81", "international": "P2_1", "number": 4, "has_inversion_symmetry": false, "lgnum": 9, "layergroup": "p2_111", "bravais_type": "Rectangular (op)", "thickness": 4.246510409497577, "label": "original03-18", "gap": 1.0536874604842614, "gap_dir": 1.1244583947473015, "gap_dir_nosoc": 1.2581465921442447, "evac": 2.893309236811458, "efermi": -5.167319575547591, "vbm": -5.694163305789722, "cbm": -4.64047584530546, "minhessianeig": -0.01680840629165037, "dyn_stab": "No", "alphax_el": 2.9642238956738307, "alphay_el": 2.844985063087663, "alphaz_el": 0.38756935843175694, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.013507951630259002, "hform": -0.12094768633573061}


unique_id: d7ae0e017eb4b4924714990d5c8342fd
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/CGeH2/CGeH2-72975dd456ac", "uid": "1CGeH2-1", "olduid": "CGeH2-6cc32f518dae", "international": "P3m1", "number": 156, "has_inversion_symmetry": false, "lgnum": 69, "layergroup": "p3m1", "bravais_type": "Hexagonal (hp)", "thickness": 3.2766296310264096, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.2293154732833811, "hform": 0.1071460013776413}


unique_id: 8c0269437dbc6e555b3c585fe9cd92d5
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABC2/MnYCl2/MnYCl2-fb2cfd268339", "uid": "1MnYCl2-1", "olduid": "MnYCl2-4532a108b5ba", "international": "P3m1", "number": 156, "has_inversion_symmetry": false, "lgnum": 69, "layergroup": "p3m1", "bravais_type": "Hexagonal (hp)", "thickness": 5.364274723895866, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.5954400372743751, "hform": -0.97498652126641}


unique_id: e7312c60482de1f5487afcbf9d667949
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABC2/InPtSe2/InPtSe2-1166ef04603e", "uid": "1InPtSe2-1", "olduid": "InPtSe2-fda9a1df742f", "international": "P1", "number": 1, "has_inversion_symmetry": false, "lgnum": 1, "layergroup": "p1", "bravais_type": "Oblique (mp)", "thickness": 3.5806066156312504, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.24506251813097935, "hform": -0.24174133927495856}


unique_id: 838c0df3e4921e7d24f089b0d13e7eeb
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/AuBiO2/Au2Bi2O4-848c0590dfaa", "uid": "2AuBiO2-1", "olduid": "Au2Bi2O4-4f09a6a764b8", "international": "Pmma", "number": 51, "has_inversion_symmetry": true, "lgnum": 41, "layergroup": "pmma", "bravais_type": "Rectangular (op)", "thickness": 6.6990007076700415, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.3259113998379155, "hform": -0.47715035512945825}


unique_id: 9c53dbfdf63564f56362a9d5a761d1fd
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/RbTiTe2/RbTiTe2-1a7ce41f988e", "uid": "1RbTiTe2-1", "olduid": "RbTiTe2-bc1de542fbd4", "international": "P3m1", "number": 156, "has_inversion_symmetry": false, "lgnum": 69, "layergroup": "p3m1", "bravais_type": "Hexagonal (hp)", "thickness": 5.90926762269118, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.25652960298030136, "hform": -0.5709274682246166}


unique_id: 6d5a6025c83d86ecd753e2db760c9233
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/LiPO2/Li4P4O8-846f2e3e7c56", "uid": "4LiPO2-2", "olduid": "Li4P4O8-491e745338ff", "international": "P2_1/c", "number": 14, "has_inversion_symmetry": true, "lgnum": 17, "layergroup": "p2_1/b11", "bravais_type": "Rectangular (op)", "thickness": 4.781345533367981, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.2002475824556389, "hform": -1.8952621466328532}


unique_id: 42016d32fb600d9c637949627450b256
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/LiPO2/Li4P4O8-ae6cc4366598", "uid": "4LiPO2-1", "olduid": "Li4P4O8-8b053ad19ac6", "international": "Pca2_1", "number": 29, "has_inversion_symmetry": false, "lgnum": 33, "layergroup": "pb2_1a", "bravais_type": "Rectangular (op)", "thickness": 4.801444946857373, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.19942996577977956, "hform": -1.8960797633087125}


unique_id: b0d29167b4db01dadae8cd1500f1fe0c
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABC2/NbSiTe2/NbSiTe2-7a77d0aab1ea", "uid": "1NbSiTe2-1", "olduid": "NbSiTe2-163cbc3bdc88", "international": "P3m1", "number": 156, "has_inversion_symmetry": false, "lgnum": 69, "layergroup": "p3m1", "bravais_type": "Hexagonal (hp)", "thickness": 6.018881301451494, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.4251362201749357, "hform": -0.03180242263233524}


unique_id: 7dc2404c1a4ffc0c4d837462e7b0e639
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/adhoc_materials/VOF2", "uid": "1OVF2-1", "olduid": "OVF2-eca6e6e9c239", "international": "Pmm2", "number": 25, "has_inversion_symmetry": false, "lgnum": 27, "layergroup": "pm2m", "bravais_type": "Rectangular (op)", "thickness": 2.485045015513128, "label": "adhoc_material", "gap": 0.7585795535608204, "gap_dir": 0.7897499911610986, "gap_dir_nosoc": 0.789426081383259, "evac": 1.2165948836800125, "efermi": -6.165590669554267, "vbm": -6.544880446334677, "cbm": -5.786300892773856, "minhessianeig": -6.154275268385853e-12, "dyn_stab": "Yes", "gap_hse": 3.3109048274751873, "gap_dir_hse": 3.3109048274751904, "efermi_hse": -6.407819422195721, "vbm_hse": -8.063271835933314, "cbm_hse": -4.752367008458128, "alphax_el": 0.9982249542986201, "alphay_el": 0.9712017585472293, "alphaz_el": 0.18197666930351208, "alphax_lat": 2.3192340442195185, "alphax": 3.3174589985181386, "alphay_lat": 1.0289592897622266, "alphay": 2.000161048309456, "alphaz_lat": 0.04570902281118146, "alphaz": 0.22768569211469353, "is_magnetic": true, "spin_axis": "x", "dE_zx": 0.024817767098284094, "dE_zy": 0.01919365877256496, "J": 12.694617672423192, "lam": -0.04415742705532466, "A": 0.0, "spin": 0.5, "N_nn": 2, "ehull": 0.001045241728220514, "hform": -2.7068811073225048}


unique_id: 8c1f5135d4d091e0e81f63d618cb3a77
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/OVF2/OVF2-4f5d6f03b9ea", "uid": "1OVF2-2", "olduid": "OVF2-22074f75b1e1", "international": "Pmmm", "number": 47, "has_inversion_symmetry": true, "lgnum": 37, "layergroup": "pmmm", "bravais_type": "Rectangular (op)", "thickness": 2.510974637668429, "label": "Lyngby22_LDP", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 1.2673299939614078, "efermi": -6.877177761697114, "dyn_stab": "Unknown", "is_magnetic": true, "spin_axis": "x", "dE_zx": 0.12316837205617048, "dE_zy": -0.06677815792954789, "ehull": 0.048603921222793556, "hform": -2.6593224278279317}


unique_id: 2677142c4e4335a47d46d464d0a738e9
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/ClCoSe2/Cl2Co2Se4-de615ffc687f", "uid": "2ClCoSe2-1", "olduid": "Cl2Co2Se4-aab978c61627", "international": "P2_1/m", "number": 11, "has_inversion_symmetry": true, "lgnum": 15, "layergroup": "p2_1/m11", "bravais_type": "Rectangular (op)", "thickness": 7.5953717415261215, "label": "Lyngby22_LDP", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 5.290902706433234, "efermi": -5.78380105623769, "minhessianeig": -0.13768687133932273, "dyn_stab": "No", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.08335154107793519, "hform": -0.2912166127516347}


unique_id: 392477dfbda4369883548de8270527c8
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/KSeO2/K4Se4O8-c8dbb624019b", "uid": "4KSeO2-1", "olduid": "K4Se4O8-05fa6ea7cfa6", "international": "P2/c", "number": 13, "has_inversion_symmetry": true, "lgnum": 7, "layergroup": "p112/a", "bravais_type": "Oblique (mp)", "thickness": 5.181699782687149, "label": "Lyngby22_LDP", "gap": 1.929387336054843, "gap_dir": 1.9321994655998087, "gap_dir_nosoc": 1.934908212800448, "evac": 1.3431866987514725, "efermi": -3.3499641396457998, "vbm": -4.314657807673221, "cbm": -2.3852704716183784, "minhessianeig": -7.504480767334478e-15, "dyn_stab": "Yes", "gap_hse": 2.7508794063134183, "gap_dir_hse": 2.7534611651333636, "efermi_hse": -3.691626177931564, "vbm_hse": -5.067065881088273, "cbm_hse": -2.3161864747748546, "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.0, "hform": -1.2627365613134787}


unique_id: e82aa3d0329846901a3d17e3e8fe89a3
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/CoNbTe2/Co4Nb4Te8-af037059d8e4", "uid": "4CoNbTe2-1", "olduid": "Co4Nb4Te8-fae8eed297ba", "international": "Pmna", "number": 53, "has_inversion_symmetry": true, "lgnum": 42, "layergroup": "pman", "bravais_type": "Rectangular (op)", "thickness": 4.694263611395542, "label": "Lyngby22_LDP", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 2.682461961352364, "efermi": -4.393078029532608, "minhessianeig": -2.7459921071647462e-15, "dyn_stab": "Yes", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.0036440789922433936, "hform": -0.404205388380646}


unique_id: 551a7faffcd15746a7e5cfa5ed355968
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_CDVAE/ABC2/HgTlCl2/HgTlCl2-5d24f2028dd8", "uid": "1HgTlCl2-1", "olduid": "HgTlCl2-161a2d858520", "international": "P1", "number": 1, "has_inversion_symmetry": false, "lgnum": 1, "layergroup": "p1", "bravais_type": "Oblique (mp)", "thickness": 3.236483727173308, "label": "Lyngby22_CDVAE", "dyn_stab": "Unknown", "ehull": 0.1770724053530649, "hform": -0.6358351026608813}


unique_id: bd3ea41701c7a1fa311a78375dd481d2
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/CrOBr2/CrOBr2-4ed37da5cecb", "uid": "1CrOBr2-1", "olduid": "CrOBr2-68f97a149ed5", "international": "Pmmm", "number": 47, "has_inversion_symmetry": true, "lgnum": 37, "layergroup": "pmmm", "bravais_type": "Rectangular (op)", "thickness": 3.5293472850280043, "label": "Lyngby22_LDP", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 1.7103047958277857, "efermi": -5.719531453970382, "dyn_stab": "Unknown", "is_magnetic": true, "spin_axis": "y", "dE_zx": -0.1282341755768357, "dE_zy": 0.029436951592742844, "ehull": 0.08008438019987008, "hform": -1.0420263624089392}


unique_id: 729e8804a101926e3229696dc7198b84
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/GeKO2/GeKO2-603f669ba807", "uid": "1GeKO2-1", "olduid": "GeKO2-95adb42dbaed", "international": "P3m1", "number": 156, "has_inversion_symmetry": false, "lgnum": 69, "layergroup": "p3m1", "bravais_type": "Hexagonal (hp)", "thickness": 3.7773509282583877, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.6446238098475376, "hform": -0.950611426707443}


unique_id: a58250fd5497629a6245c9d1cf5325d7
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/ClPdS2/Cl2Pd2S4-836a4f319206", "uid": "2ClPdS2-1", "olduid": "Cl2Pd2S4-45c9ac592c20", "international": "P2_1/m", "number": 11, "has_inversion_symmetry": true, "lgnum": 15, "layergroup": "p2_1/m11", "bravais_type": "Rectangular (op)", "thickness": 7.509563924219623, "label": "Lyngby22_LDP", "gap": 0.0, "gap_dir": 0.0, "gap_dir_nosoc": 0.0, "evac": 4.4600893588224615, "efermi": -5.006223127003385, "minhessianeig": -0.046919206342780836, "dyn_stab": "No", "is_magnetic": false, "spin_axis": "z", "dE_zx": 0.0, "dE_zy": 0.0, "ehull": 0.08184698728621381, "hform": -0.2311104650419682}


unique_id: ade1177c4c8bc777b97071647e99e2c9
username: cmr
calculator: unknown
calculator_parameters: {}
key_value_pairs:
  {"folder": "/home/niflheim2/cmr/C2DB-ASR/tree_LDP/ABC2/BrNaS2/Br2Na2S4-63d681bf9afb", "uid": "2BrNaS2-1", "olduid": "Br2Na2S4-ec6a44972e64", "international": "P-42_1m", "number": 113, "has_inversion_symmetry": false, "lgnum": 58, "layergroup": "p-42_1m", "bravais_type": "Square (tp)", "thickness": 4.129231683869541, "label": "Lyngby22_LDP", "dyn_stab": "Unknown", "ehull": 0.7657285405845928, "hform": -0.03714719038068459}


unique_id: e412a9f3241af70cb90b5efec2be616c
username: cmr
calculator: unknown
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