CCP-NC / soprano

Related projects ⓘ

Alternatives and complementary repositories for soprano

• bjmorgan / bsym
  A Basic Symmetry Module (Python)
  ☆15Updated 5 months ago
• abelcarreras / posym
  Point symmetry analysis tool for theoretical chemistry objects
  ☆17Updated 2 months ago
• optados-developers / optados
  Official Repository of the Optados code
  ☆21Updated this week
• uw-cmg / MAST
  MAterials Simulation Toolkit for use with pymatgen
  ☆17Updated 9 months ago
• nomad-coe / electronic-parsers
  ☆19Updated this week
• siesta-project / tutorials
  Tutorial material for hands-on sessions (work in progress)
  ☆22Updated 3 years ago
• diffpy / pyobjcryst
  Python bindings to ObjCryst++ Object-Oriented Crystallographic Library
  ☆15Updated last month
• QEF / postqe
  ☆16Updated last year
• hema-ted / pycdft
  ☆31Updated 4 years ago
• jarvist / Julia-Phonons
  Julia codes to play with Phonons
  ☆22Updated 6 years ago
• alexvakimov / pyxaid-code
  The main branch of the Pyxaid code
  ☆12Updated 7 years ago
• WMD-group / PyTASER
  Python package to simulate differential absorption spectra of crystals from first principles
  ☆25Updated 9 months ago
• qmcurrents / gimic
  Gauge-including magnetically induced currents.
  ☆28Updated 11 months ago
• NU-CEM / ThermoPot
  Python package for calculating thermodynamic potentials from first-principles calculations
  ☆14Updated 11 months ago
• MDIL-SNU / AMP2
  ☆20Updated last year
• atomisticnet / xas-tools
  Tools related to X-ray absorption spectroscopy (XAS)
  ☆17Updated 4 months ago
• haidi-ustc / maptool
  Materials Project Tool : An useful tool for manipulating, analying and visualization input and output of materials simulation codes.
  ☆16Updated last year
• jochym / abinitio-methods
  Lecture materials for: Ab initio methods in solid state physics.
  ☆21Updated 2 months ago
• QEF / SternheimerGW
  many-body perturbation theory without empty states
  ☆11Updated 6 years ago
• ifilot / den2obj
  Generate isosurface from density data
  ☆12Updated 2 months ago
• environ-developers / Environ
  A fortran package and library for continuum embedding calculations in materials and molecules
  ☆18Updated 4 months ago
• SMTG-Bham / galore
  Gaussian and Lorentzian smearing of simulated spectra
  ☆35Updated last month
• pfloos / QuAcK
  QuAcK: a software for emerging quantum electronic structure methods
  ☆24Updated last week
• Yang-Laboratory / losc
  Library for local orbital scaling correction (LOSC).
  ☆15Updated 4 months ago
• obackhouse / gmtkn
  GMTKN test sets in python
  ☆9Updated 2 years ago
• pulkin / openmx-hks
  A tool to read and operate OpenMX HKS (Kohn-Sham Hamiltonian) files
  ☆15Updated 3 years ago
• SCM-NV / nano-qmflows
  Package containing several workflows to compute molecular properties for nanomaterials
  ☆10Updated 4 months ago
• tdep-developers / tdep-tutorials
  TDEP Tutorials
  ☆20Updated last year
• janberges / elphmod
  Python modules for electron–phonon models
  ☆29Updated this week
• materialsvirtuallab / nano106
  Course materials for NANO 106 - Crystallography of Materials
  ☆33Updated 2 years ago