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Parameter Settings for Calculating GaAs EPC Matrix

Status: Open.

#15 In QuantumLab-ZY/HamEPC;

· 3532564593 opened on Nov 3, 2025

from numpy_extension import eliashberg_spectrum_cal_helper_sparse

Status: Open.

#14 In QuantumLab-ZY/HamEPC;

· 13-shisan opened on Sep 27, 2025

MPI job fails due to startup timeout

Status: Open.

#13 In QuantumLab-ZY/HamEPC;

· Zhengsx-p opened on Aug 1, 2025

An error occurred when using graph_data_gen

Status: Open.

#12 In QuantumLab-ZY/HamEPC;

· Zhengsx-p opened on Jul 22, 2025

No speedup observed when increasing MPI processes

Status: Open.

#11 In QuantumLab-ZY/HamEPC;

· cl25796 opened on May 8, 2025

grad_mat_prep for siesta

Status: Open.

#10 In QuantumLab-ZY/HamEPC;

· Youhaojen opened on Mar 8, 2025

NameError: name 'atomic_nums' is not defined

Status: Open.

#9 In QuantumLab-ZY/HamEPC;

· Vahid999 opened on Dec 1, 2024

Questions Regarding Using HamGNN Potential Trained with ABACUS Data for HamEPC Calculations

Status: Open.

#8 In QuantumLab-ZY/HamEPC;

· BraunSakai opened on Nov 22, 2024

KeyError: 'Mon' on mobility calculation of GaAs

Status: Open.

#7 In QuantumLab-ZY/HamEPC;

· Vahid999 opened on Nov 18, 2024

Memory Insufficiency Error When Running GaAs Example in HamEPC Project

Status: Open.

#6 In QuantumLab-ZY/HamEPC;

· witt2000 opened on Oct 30, 2024

Which version of pymatgen is required for installation of HamEPC?

Status: Open.

#5 In QuantumLab-ZY/HamEPC;

· Vahid999 opened on Oct 23, 2024

elements with f orbitals

Status: Open.

#4 In QuantumLab-ZY/HamEPC;

· gaoxuew opened on Oct 11, 2024