Python QcfpConfig.k_couplings示例

#cfg.system_hamiltonian = [[15260., 150., 45.], # Pd1
#                          [150., 15190., 45.], # Pd2
#                          [45., 45., 15182.], # CT state
#                          ]
cfg.system_hamiltonian = [
    [15260., 0.],  # Pd1
    [0., 15190.],  # Pd2
    #[45., 45., 15182.], # CT state
]

cfg.spectral_density_couplings = [[1., 1.]]

#cfg.k_couplings = [[0., 0., 0.],
#                   [0., 0., 0.],
#                   [0., 0., 0.]]
cfg.k_couplings = [[0., 0.], [0., 0.]]

cfg.system_type = 'paulionic'  # two-level systems

# directions of dipoles
cfg.system_dipoles = [
    [-0.7513666, 0.36257354, 0.55135167],  # Pd1
    [0.95124446, 0.0857395, 0.29628147],  # Pd2
    #[-0.78834349, -0.28475419, 0.54537106], # CT state direction
]

# direction of static dipoles
cfg.delta_mu = cfg.system_dipoles

# site disorder configuration
fwhm_factor = 2 * np.sqrt(2 * np.log(2))

示例#2

显示文件

文件： make-cfg.py 项目： antonl/stark-theory-paper

#                          ]
cfg.system_hamiltonian = [
    [15260.],  # Pd1
    #[150., 15190.], # Pd2
    #[45., 45., 15182.], # CT state
]

#cfg.spectral_density_couplings = [[1., 1.]]
cfg.spectral_density_couplings = [[1.]]

#cfg.k_couplings = [[0., 0., 0.],
#                   [0., 0., 0.],
#                   [0., 0., 0.]]
#cfg.k_couplings = [[0., 0.],
#                   [0., 0.]]
cfg.k_couplings = [[0.]]

cfg.system_type = 'paulionic'  # two-level systems

# directions of dipoles
cfg.system_dipoles = [
    [-0.7513666, 0.36257354, 0.55135167],  # Pd1
    #[0.95124446, 0.0857395,  0.29628147], # Pd2
    #[-0.78834349, -0.28475419, 0.54537106], # CT state direction
]

# direction of static dipoles
cfg.delta_mu = cfg.system_dipoles

# site disorder configuration
fwhm_factor = 2 * np.sqrt(2 * np.log(2))