Alternatives and similar repositories for VaspCZ

Users that are interested in VaspCZ are comparing it to the libraries listed below

• B-C-WANG / VaspStudio
  An useful tool to submit your VASP job on HPC, manage your jobs and extract eneries...自动化VASP任务提交、计算结果提取，任务文件管理的工具
  ☆76Updated 4 years ago
• Chengcheng-Xiao / VASP_OPT_AXIS
  Fix lattice component(s) during relaxation in VASP
  ☆123Updated 3 years ago
• tamaswells / VASPKIT_manual
  VASPKIT_manual markdown source!
  ☆79Updated 6 years 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
• MabinogiX / VASP-script
  ☆122Updated 6 years ago
• tamaswells / XDATCAR_toolkit
  XDATCAR_toolkit- A tool for convert XDATCAR to PDB
  ☆61Updated 6 years ago
• ryyesterday / VASP
  A collection of scripts to interpret/organize VASP output files
  ☆24Updated 8 years ago
• Tingliangstu / Lammps_tools
  Some scripting tools used for lammps input or output
  ☆59Updated 3 months ago
• tamaswells / VASP_script
  Useful scripts for VASP
  ☆192Updated 3 years ago
• FourPhonon / FourPhonon
  An extension module to ShengBTE for computing four-phonon scattering rates and thermal conductivity
  ☆68Updated last month
• WatsonGroupTCD / Occupation-matrix-control-in-VASP
  Occupation matrix control modification VASP
  ☆49Updated 5 years ago
• tyst3273 / phonon-sed
  Python codes to calculate phonon spectral energy density from LAMMPS velocity data.
  ☆27Updated 4 years ago
• abelcarreras / DynaPhoPy
  Phonon anharmonicity analysis from molecular dynamics
  ☆130Updated 9 months ago
• QijingZheng / Hefei-NAMD
  ab-initio nonadiabatic molecular dynamics program
  ☆110Updated last year
• BigBroSci-LVTHW / LVTHW
  ☆57Updated 8 months ago
• AdityaRoy-1996 / Phonopy_VESTA
  Export Eigenvectors from Phonopy format to VESTA
  ☆46Updated 7 months ago
• Ionizing / usefultools-for-vasp
  A lite tool for monitoring convergence in VASP relaxation
  ☆17Updated last year
• oekosheri / GB_code
  A grain boundary generation code
  ☆71Updated last year
• QijingZheng / pyband
  band plot using python matplotlib
  ☆171Updated 9 months ago
• FourPhonon / Fourthorder
  In analogy with thirdorder.py in ShengBTE, Fourthorder.py is developed to calculate fourth-order interatomic force-constants (4th-IFCs). …
  ☆27Updated last year
• 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…
  ☆55Updated 6 years ago
• kavanase / vaspup2.0
  VASP Convergence Testing (for Energy & Dielectric Constants)
  ☆55Updated last year
• cndaqiang / DFT-EXERCISES
  DENSITY FUNCTIONAL THEORY EXERCISES. 本习题解答针对 DAVID S. SHOLL 的 Density functional theory: a practical introduction[1]一书。理论依据为密度泛函(DFT)理论，…
  ☆63Updated 3 years ago
• afonari / emc
  Effective Mass Calculator for Semiconductors
  ☆110Updated 4 years ago
• mbkumar / pycdt
  ☆56Updated 3 years ago
• kumagai-group / pydefect
  Python library for point-defect calculations in non-metallic solids based on first-principle calculations with the VASP code.
  ☆62Updated last week
• maituoy / BayesianOpt4dftu
  ☆39Updated last year
• mxchen-2020 / kproj
  KPROJ: A Band Unfolding Program
  ☆45Updated 6 months ago
• c-niu / sqs2poscar
  A c++ code to convert bestsqs.out from mcsqs (ATAT) to POSCAR for VASP.
  ☆34Updated 9 years ago
• yjzhang97 / pymatgen_bs_dos_plot
  ☆22Updated 4 years ago