Alternatives and similar repositories for CN-related-SACs

Users that are interested in CN-related-SACs are comparing it to the libraries listed below

• XuhaoWan / HEA-ORR
  ☆19Updated 6 months ago
• XuhaoWan / Pc_CO2RR_ML
  ☆25Updated 3 years ago
• XuhaoWan / HEA-LM
  ☆19Updated 2 years ago
• joelager / Electrocatalysis-microkinetic-analysis
  Microkinetic models for electrochemical CO stripping and hydrogen oxidation
  ☆13Updated 4 years ago
• conodipaola / kg4vasp
  Kubo-Greenwood for transport properties from First Principle Molecular Dynamics with VASP
  ☆23Updated 4 years ago
• ZhongweiZhangsite / WPPT
  Wavelike and Particlelike Phonon Transport (WPPT) Solver
  ☆27Updated 5 months ago
• penghao-xiao / Electrochemical-barrier
  ☆26Updated 2 years ago
• mbkumar / pycdt
  ☆50Updated 2 years ago
• mzkhalid039 / DWBuilder
  Ferroelectric/Ferroelastic domain wall builder
  ☆18Updated 7 months ago
• yangjio4849 / TransOpt
  The package TransOpt makes it possible for VASP users to calculate electrical transport properties (Seebeck coefficients, electrical cond…
  ☆54Updated 2 years ago
• Shiliang2333 / PotentialForHEA
  收集和整理适用于高熵合金分子动力学模拟的势函数。A set of interatomic potentials suitable for molecular dynamics simulations of high entropy alloys.
  ☆23Updated last month
• hellozhaoming / FCP-vasp-ase
  ASE interface for fully constant potential with VASP
  ☆32Updated 7 months ago
• SMTG-Bham / ThermoParser
  A tool for streamlining data analysis and visualisation for thermoelectrics and charge carrier transport in computational materials scien…
  ☆52Updated last week
• mogroupumd / interface_stability
  ☆16Updated 5 years ago
• brucefan1983 / AGF-phonon-transport
  A 200-line Matlab implementation of the Atomistic Green's function (AGF) method for phonon transport
  ☆25Updated 5 years ago
• XuhaoWan / DMCP
  ☆238Updated last year
• gabkrenzer / vaspMD
  A collection of tips, scripts, tools and files to improve your workflow, or simply help you start with ab initio Molecular Dynamics (AIMD…
  ☆21Updated last year
• rjacobs914 / VASP-Tools
  A set of tools used for setup, analysis and post-processing of Density Functional Theory (DFT) calculations performed with the VASP packa…
  ☆16Updated 7 years ago
• SINGROUP / VASP
  Scripts for analyzing VASP output and preparing VASP input, especially for NEB calculations.
  ☆20Updated 6 years ago
• eminamitani / thermal_conductivity_code
  Allen-Feldman thermal conductivity compatible to GULP implementation
  ☆19Updated last month
• spenser-lu / RASPA_tools
  适用于多孔材料吸附性质模拟软件——RASPA的脚本工具集合，可用于并行计算等温线、高通量模拟，zeo++参数自动化计算、批量结果分析等。A collection of scripting tools for RASPA, which can be used for para…
  ☆48Updated last month
• K4ys4r / BoltzTraP_Tools
  BoltzTraP_Tools is an interface written using Python 2 language. It allows to parse and plot BoltzTraP output DATA
  ☆19Updated 4 years ago
• gabkrenzer / PhononFlow
  A collection of tips, scripts, tools, and files to enable a better workflow for phonon calculations using VASP and phonopy.
  ☆34Updated 2 years ago
• sarizzm / microkinetic-model
  microkinetic model of chemical reaction, 微观动力学模型总结
  ☆12Updated 2 years ago
• mz8879813 / LammpsPostprocessing
  Postprocessing of Lammps outfile to analyze ReaxFF dyanamics data
  ☆13Updated 6 years ago
• rehnd / VASP-plot-modes
  Tool for plotting modes generated by DFPT calculations (IBRION=7 or 8) in VASP
  ☆32Updated last year
• Asif-Iqbal-Bhatti / High-Entropy-Alloys
  Generate random alloys and compute various properties
  ☆53Updated 5 months ago
• VASPsol / VASPsol
  ☆48Updated last month
• tamaswells / XDATCAR_toolkit
  XDATCAR_toolkit- A tool for convert XDATCAR to PDB
  ☆60Updated 5 years ago
• ksaaskil / shc-python-tools
  Python tools for calculating the spectral heat current distribution from LAMMPS NEMD simulations
  ☆28Updated 3 years ago