sumk_dft_transport

Functions

cellvolume(lattice_type, lattice_constants, ...)

Determines the conventional und primitive unit cell volumes.

conductivity_and_seebeck(Gamma_w, omega, ...)

Calculates the Seebeck coefficient and the optical conductivity by calling transport_coefficient.

fermi_dis(w, beta[, der])

Fermi distribution.

init_spectroscopy(sum_k[, code, w90_params])

Reads all necessary quantities for transport calculations from transport subgroup of the hdf5 archive.

read_transport_input_from_hdf(sum_k)

Reads the data for transport calculations from the hdf5 archive. Parameters ---------- sum_k : sum_k object triqs SumkDFT object Returns ------- sum_k : sum_k object triqs SumkDFT object.

recompute_w90_input_on_different_mesh(sum_k, ...)

Recomputes dft_input objects on a finer mesh using WannierBerri and Wannier90 input.

transport_coefficient(Gamma_w, omega, ...[, ...])

Calculates the transport coefficient A_n in a given direction for a given \(\Omega\).

transport_distribution(sum_k, beta[, ...])

Calculates the transport distribution

transport_function(beta, directions, ...)

Calculates the transport function

write_output_to_hdf(sum_k, things_to_save[, ...])

Saves data from a list into the HDF file.