# systems

unique_id: bc4c361588bad535dcd6c5950e67b605
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0]}}]
calculator: gpaw
key_value_pairs: {"name": "N/1Ru(0001)", "nkpts": 7, "ecut": 400, "height": 1.1970804223364806}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 400.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [7, 7, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: 4fabf9c59f242738754e2370c0a20d52
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 4, "ecut": 400, "height": 1.2269051948197234}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 400.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [4, 4, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: d3605ef028a3c5e46dd5d6cf62b1caf7
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 5, "ecut": 400, "height": 1.1997440884851667}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 400.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [5, 5, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: 4023ba20bedd802b94f2399e90c7a383
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 6, "ecut": 400, "height": 1.2134662746180798}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 400.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [6, 6, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: e571fa86553c46b18e4bfd43a5c3414c
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 8, "ecut": 400, "height": 1.190188687357292}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 400.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [8, 8, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: 900a4c0b7c32ab476cf070be8c0557cf
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 9, "ecut": 400, "height": 1.1997440884851667}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 400.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [9, 9, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: 3bf866942ac88c42b98617513b6799d3
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 10, "ecut": 400, "height": 1.1965947165773354}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 400.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [10, 10, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: b35535e63317f4a063a6ddbeae5dd1c3
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 11, "ecut": 400, "height": 1.1965947165773354}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 400.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [11, 11, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: deb88681dceaf7a796bd7e630a01f6f4
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 7, "ecut": 350, "height": 1.2147331360773554}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 350.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [7, 7, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: 9f94835b27125f51d7c10480d0f95efd
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 7, "ecut": 450, "height": 1.1943199169332024}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 450.00000000000006}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [7, 7, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: 85132c4ab4356c6ff72a305f49815223
username: jensj
calculator: gpaw
key_value_pairs: {"name": "N-atom", "ecut": 450}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 450.00000000000006}, "xc": "PBE", "eigensolver": {"name": "dav", "niter": 2}}


unique_id: 65d9681702762212be4b049e893b7cd9
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 7, "ecut": 500, "height": 1.1889412975684301}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 500.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [7, 7, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: e6daafff4c44fe4cdab7185fb7fba21c
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 7, "ecut": 550, "height": 1.1847393951944571}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 550.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [7, 7, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: 1af133802d37490dba5b527a26242122
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 7, "ecut": 600, "height": 1.179875938398328}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 600.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [7, 7, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: 6f4159df355215c3cf07de2413f05d02
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 7, "ecut": 650, "height": 1.1798759383983288}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 650.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [7, 7, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: 669872190d6b7d60c85db704103922ba
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 7, "ecut": 700, "height": 1.1798759383983288}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 700.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [7, 7, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: 8f8d6471d538ed447e5adbec6e4d47e9
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 7, "ecut": 750, "height": 1.1798759383983288}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 750.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [7, 7, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: 76283b92dae5eee2c1d9b79a33376a63
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 7, "ecut": 800, "height": 1.179126008324821}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 800.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [7, 7, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: a738258537f6860f65fa43d95d55613e
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 12, "ecut": 400, "height": 1.1933768716086126}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 400.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [12, 12, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: ea599e356d071c36d40e9f8841f0155b
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 13, "ecut": 400, "height": 1.1955827540624053}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 400.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [13, 13, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: 61c520b65f0d9f53ae44b9173d970d62
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 14, "ecut": 400, "height": 1.1972047112618718}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 400.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [14, 14, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: e3fb3b23ca5c66d59fadfd8666b32de8
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 15, "ecut": 400, "height": 1.1953598728357182}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 400.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [15, 15, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: b3d976e2ff28a0e44653fa8fbdbe68ec
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 16, "ecut": 400, "height": 1.1972047112618718}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 400.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [16, 16, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


unique_id: a5190d8fee388f3a7e2f1f34142c89bf
username: jensj
constraints: [{"name": "FixAtoms", "kwargs": {"indices": [0, 1]}}]
calculator: gpaw
key_value_pairs: {"name": "N/2Ru(0001)", "nkpts": 17, "ecut": 400, "height": 1.1972047112618718}
data: {}
calculator_parameters:
  {"mode": {"name": "pw", "ecut": 400.0}, "xc": "PBE", "poissonsolver": {"dipolelayer": "xy"}, "kpts": {"size": [17, 17, 1], "gamma": true}, "eigensolver": {"name": "dav", "niter": 2}}


