Pinned Repositories
Euler-Lagrange-Saddle-Point-Finder
This script does not implement any known saddle point search schemes such as the Dimer method or Nudged Elastic Band (NEB) method. It employs a unique approach based on the Euler-Lagrange equation to find the MEP directly by minimizing the action integral.
faridf
Config files for my GitHub profile.
faridfattahpour.github.io
Phase-Diagram-Calculator-ThermoCalc
Phase Diagram Calculator in ThermoCalc with Python
Phonon-Band-Structure-Unfolding
The script unfolds phonon bands from a supercell calculation back to the primitive cell Brillouin zone, which is particularly useful for analyzing systems with defects, disorders, or complex structures.
Read-TDEP-Force-Constant-with-python
Read TDEP Force Constant with python
VASP-6.3.0-Docker-Build-with-GPU-Support
This repository contains files for building VASP 6.3.0 with GPU support using NVIDIA HPC SDK. The build supports both GPU and CPU execution modes.
Yield-Strength-Calculation-using-Thermo-Calc-Python
This repository contains a Python script that demonstrates how to calculate the yield strength of a specified alloy composition using the Thermo-Calc Python (tc_python) API. It sets up the thermodynamic system, selects the property model, configures the required parameters, and prints out the available results.
faridf's Repositories
faridf/Euler-Lagrange-Saddle-Point-Finder
This script does not implement any known saddle point search schemes such as the Dimer method or Nudged Elastic Band (NEB) method. It employs a unique approach based on the Euler-Lagrange equation to find the MEP directly by minimizing the action integral.
faridf/faridf
Config files for my GitHub profile.
faridf/faridfattahpour.github.io
faridf/Phase-Diagram-Calculator-ThermoCalc
Phase Diagram Calculator in ThermoCalc with Python
faridf/Phonon-Band-Structure-Unfolding
The script unfolds phonon bands from a supercell calculation back to the primitive cell Brillouin zone, which is particularly useful for analyzing systems with defects, disorders, or complex structures.
faridf/Read-TDEP-Force-Constant-with-python
Read TDEP Force Constant with python
faridf/VASP-6.3.0-Docker-Build-with-GPU-Support
This repository contains files for building VASP 6.3.0 with GPU support using NVIDIA HPC SDK. The build supports both GPU and CPU execution modes.
faridf/Yield-Strength-Calculation-using-Thermo-Calc-Python
This repository contains a Python script that demonstrates how to calculate the yield strength of a specified alloy composition using the Thermo-Calc Python (tc_python) API. It sets up the thermodynamic system, selects the property model, configures the required parameters, and prints out the available results.