def _run_thm_c_with_band_indices(self):
import anharmonic._phono3py as phono3c
phono3c.thm_imag_self_energy(self._imag_self_energy, self._pp_strength,
self._triplets_at_q, self._weights_at_q,
self._frequencies, self._temperature,
self._g, self._unit_conversion,
self._cutoff_frequency)
def _run_thm_c_with_band_indices(self):
import anharmonic._phono3py as phono3c
phono3c.thm_imag_self_energy(
self._imag_self_energy,
self._interaction.get_interaction_strength(),
self._grid_point_triplets, self._triplet_weights,
self._frequencies, self._temperature, self._g,
np.array(self._band_indices).flatten().astype('intc'),
self._unit_conversion, self._cutoff_frequency)
def _run_thm_c_with_band_indices(self):
import anharmonic._phono3py as phono3c
phono3c.thm_imag_self_energy(self._imag_self_energy,
self._fc3_normal_squared,
self._triplets_at_q,
self._weights_at_q,
self._frequencies,
self._temperature,
self._g,
self._unit_conversion,
self._cutoff_frequency)
def _run_thm_c_with_frequency_points(self):
import anharmonic._phono3py as phono3c
g = np.zeros((2, ) + self._fc3_normal_squared.shape, dtype='double')
for i in range(len(self._frequency_points)):
for j in range(g.shape[2]):
g[:, :, j, :, :] = self._g[:, :, i, :, :]
phono3c.thm_imag_self_energy(
self._imag_self_energy[i], self._fc3_normal_squared,
self._triplets_at_q, self._weights_at_q, self._frequencies,
self._temperature, g, self._unit_conversion,
self._cutoff_frequency)
def _run_thm_c_with_band_indices(self):
import anharmonic._phono3py as phono3c
phono3c.thm_imag_self_energy(self._imag_self_energy,
self._interaction.get_interaction_strength(),
self._grid_point_triplets,
self._triplet_weights,
self._frequencies,
self._temperature,
self._g,
np.array(self._band_indices).flatten().astype('intc'),
self._unit_conversion,
self._cutoff_frequency)
def _run_thm_c_with_frequency_points(self):
import anharmonic._phono3py as phono3c
g = np.zeros((2, ) + self._interaction.shape, dtype='double')
ise_at_f = np.zeros(self._imag_self_energy.shape[1], dtype='double')
for i in range(len(self._fpoints)):
for j in range(g.shape[2]):
g[:, :, j, :, :] = self._g[:, :, i, :, :]
phono3c.thm_imag_self_energy(ise_at_f, self._interaction,
self._grid_point_triplets,
self._triplet_weights,
self._frequencies, self._temperature,
g, self._unit_conversion,
self._cutoff_frequency)
self._imag_self_energy[i] = ise_at_f
def _run_thm_c_with_frequency_points(self):
import anharmonic._phono3py as phono3c
g = np.zeros((2,) + self._fc3_normal_squared.shape, dtype='double')
for i in range(len(self._frequency_points)):
for j in range(g.shape[2]):
g[:, :, j, :, :] = self._g[:, :, i, :, :]
phono3c.thm_imag_self_energy(self._imag_self_energy[i],
self._fc3_normal_squared,
self._triplets_at_q,
self._weights_at_q,
self._frequencies,
self._temperature,
g,
self._unit_conversion,
self._cutoff_frequency)
def _run_thm_c_with_frequency_points(self):
import anharmonic._phono3py as phono3c
g = np.zeros((2,) + self._interaction.shape, dtype='double')
ise_at_f = np.zeros(self._imag_self_energy.shape[1], dtype='double')
for i in range(len(self._fpoints)):
for j in range(g.shape[2]):
g[:, :, j, :, :] = self._g[:, :, i, :, :]
phono3c.thm_imag_self_energy(ise_at_f,
self._interaction,
self._grid_point_triplets,
self._triplet_weights,
self._frequencies,
self._temperature,
g,
self._unit_conversion,
self._cutoff_frequency)
self._imag_self_energy[i] = ise_at_f
