Alternatives and similar repositories for microkinetic-model

Users that are interested in microkinetic-model are comparing it to the libraries listed below

• hellozhaoming / FCP-vasp-ase
  ASE interface for fully constant potential with VASP
  ☆40Updated last year
• tamaswells / XDATCAR_toolkit
  XDATCAR_toolkit- A tool for convert XDATCAR to PDB
  ☆62Updated 6 years ago
• yuanyue-liu-group / CP-VASP
  ☆60Updated last year
• penghao-xiao / Electrochemical-barrier
  ☆30Updated 3 years ago
• QijingZheng / Hefei-NAMD
  ab-initio nonadiabatic molecular dynamics program
  ☆116Updated last year
• VASPsol / VASPsol
  ☆73Updated 8 months ago
• MabinogiX / VASP-script
  ☆127Updated 6 years ago
• WatsonGroupTCD / Occupation-matrix-control-in-VASP
  Occupation matrix control modification VASP
  ☆53Updated 6 years ago
• conodipaola / kg4vasp
  Kubo-Greenwood for transport properties from First Principle Molecular Dynamics with VASP
  ☆26Updated 5 years ago
• maituoy / BayesianOpt4dftu
  ☆41Updated last year
• materialscloud-org / tools-phonon-dispersion
  Visualize interactively phonon dispersions and their eigenvectors
  ☆14Updated 10 months ago
• bigbrosci / q-robot
  ☆24Updated 2 months ago
• zglan / JADE-NAMD
  JADE-NAMD: An package for the on-the-fly nonadiabatic molecular dynamics simulation
  ☆19Updated 4 years ago
• SMTG-Bham / surfaxe
  Dealing with slabs for first principles calculations of surfaces
  ☆65Updated 2 years ago
• AdityaRoy-1996 / Phonopy_VESTA
  Export Eigenvectors from Phonopy format to VESTA
  ☆50Updated 11 months ago
• bigd4 / PyNEP
  A python interface of NEP
  ☆66Updated last month
• ponychen123 / Vasptools
  some toolkits for VASP
  ☆32Updated 4 years ago
• avishart / CP2K_Editor
  CP2K Editor is a simple GUI for creating input files in the atomistic program CP2K. It is a easy and fast way to create the complex input…
  ☆57Updated 6 years ago
• QijingZheng / VaspVib2XSF
  Visualize vibrational modes from VASP calculations
  ☆45Updated 10 months ago
• yangjio4849 / TransOpt
  The package TransOpt makes it possible for VASP users to calculate electrical transport properties (Seebeck coefficients, electrical cond…
  ☆55Updated 3 years ago
• SMTG-Bham / ThermoParser
  A tool for streamlining data analysis and visualisation for thermoelectrics and charge carrier transport in computational materials scien…
  ☆52Updated 7 months ago
• mogroupumd / aimd
  ☆45Updated 7 years ago
• SSlakeLabTiangong / 2019_workshop
  ☆16Updated 5 years ago
• ryyesterday / VASP
  A collection of scripts to interpret/organize VASP output files
  ☆24Updated 9 years ago
• mbkumar / pycdt
  ☆61Updated 3 years ago
• JMSkelton / VASP-Examples
  A collection of examples for running different types of VASP calculations.
  ☆31Updated 9 years ago
• bitsoal / VASP_HTC_framework
  High-throughput calculation framework for VASP
  ☆25Updated 4 months ago
• QijingZheng / pyband
  band plot using python matplotlib
  ☆177Updated last year
• tamaswells / VASPKIT_manual
  VASPKIT_manual markdown source!
  ☆80Updated 6 years ago
• jrschmidt2 / periodic-NBO
  ☆36Updated 6 years ago