maxwelllink package

Subpackages

• maxwelllink.cli package
  • Submodules
    • maxwelllink.cli.mxl module
      • main()
    • maxwelllink.cli.mxl_clean module
      • clean_workspace()
      • mxl_clean_main()
    • maxwelllink.cli.mxl_hpc module
      • ensure_default_hpc_profile()
      • mxl_hpc_main()
      • set_hpc_profile()
    • maxwelllink.cli.mxl_init module
      • initialize_workspace()
      • mxl_init_main()
• maxwelllink.em_solvers package
  • Submodules
    • maxwelllink.em_solvers.dummy_em module
      • DummyEMSimulation
      • DummyEMUnits
      • MoleculeDummyWrapper
    • maxwelllink.em_solvers.laser_driven module
      • LaserDrivenSimulation
      • LaserDrivenUnits
      • MoleculeLaserDrivenWrapper
    • maxwelllink.em_solvers.meep module
      • MeepSimulation
      • MeepUnits
      • MoleculeMeepWrapper
      • meep_units_helper()
      • update_molecules()
      • update_molecules_no_mpi()
      • update_molecules_no_socket()
    • maxwelllink.em_solvers.multimode_cavity module
      • FabryPerotCavity
      • MoleculeMultiModeWrapper
      • MultiModeSimulation
      • MultiModeUnits
    • maxwelllink.em_solvers.single_mode_cavity module
      • DummyThermostat
      • LangevinThermostat
      • MoleculeSingleModeWrapper
      • SingleModeSimulation
      • SingleModeUnits
• maxwelllink.molecule package
  • Submodules
    • maxwelllink.molecule.molecule module
      • Molecule
      • Vector3
    • maxwelllink.molecule.molecule_legacy module
      • DummyMolecule
      • SocketMolecule
      • TLSMolecule
      • atomic_to_meep_units_SourceAmp()
      • make_custom_time_src()
      • meep_to_atomic_units_E()
      • reset_module_state()
      • update_molecules()
      • update_molecules_no_mpi()
      • update_molecules_no_socket()
• maxwelllink.mxl_drivers package
  • Subpackages
    • maxwelllink.mxl_drivers.lammps package
      • Submodules
    • maxwelllink.mxl_drivers.python package
      • Subpackages
      • Submodules
• maxwelllink.sockets package
  • AggregatedSocketHub
    • AggregatedSocketHub.__init__()
    • AggregatedSocketHub.add_bridge()
    • AggregatedSocketHub.all_bound()
    • AggregatedSocketHub.graceful_shutdown()
    • AggregatedSocketHub.init_remote_bridges()
    • AggregatedSocketHub.register_molecule()
    • AggregatedSocketHub.register_molecule_return_id()
    • AggregatedSocketHub.step_barrier()
    • AggregatedSocketHub.stop()
    • AggregatedSocketHub.wait_until_bound()
  • LocalSocketHubBridge
    • LocalSocketHubBridge.__init__()
    • LocalSocketHubBridge.local_endpoint
    • LocalSocketHubBridge.run()
    • LocalSocketHubBridge.start()
    • LocalSocketHubBridge.stop()
  • RemoteBridgeSpec
    • RemoteBridgeSpec.__init__()
    • RemoteBridgeSpec.from_dict()
    • RemoteBridgeSpec.group_id
    • RemoteBridgeSpec.idx
    • RemoteBridgeSpec.n_molecules
    • RemoteBridgeSpec.to_dict()
    • RemoteBridgeSpec.unixsocket
  • SocketHub
    • SocketHub.__init__()
    • SocketHub.all_bound()
    • SocketHub.graceful_shutdown()
    • SocketHub.register_molecule()
    • SocketHub.register_molecule_return_id()
    • SocketHub.step_barrier()
    • SocketHub.stop()
    • SocketHub.wait_until_bound()
  • am_master()
  • get_available_host_port()
  • mpi_bcast_from_master()
  • run_bridge_node()
  • Submodules
    • maxwelllink.sockets.aggregated module
      • AggregatedBridge
      • AggregatedSocketHub
      • LocalSocketHubBridge
      • RemoteBridgeSpec
      • mxl_bridge_main()
      • run_bridge_node()
    • maxwelllink.sockets.sockets module
      • SocketHub
      • am_master()
      • get_available_host_port()
      • mpi_bcast_from_master()
• maxwelllink.tools package
  • calc_transverse_components_3d()
  • cosine_drive()
  • gaussian_enveloped_cosine()
  • gaussian_pulse()
  • ir_spectrum()
  • k_parallel_pulse()
  • lr_tddft_spectrum()
  • rt_tddft_spectrum()
  • Submodules
    • maxwelllink.tools.harmonic_oscillator_helper module
      • DummyInitializer
      • DummyThermostat
      • LangevinThermostat
      • MaxwellBoltzmannInitializer
    • maxwelllink.tools.ir module
      • auto_correlation_function()
      • fft()
      • ir_spectrum()
      • smooth()
    • maxwelllink.tools.pulses module
      • cosine_drive()
      • gaussian_enveloped_cosine()
      • gaussian_pulse()
      • k_parallel_pulse()
    • maxwelllink.tools.tddft_spectrum module
      • lr_tddft_spectrum()
      • rt_tddft_spectrum()
    • maxwelllink.tools.transverse_components module
      • calc_transverse_components_3d()

Submodules

• maxwelllink.units module
  • unit()