Recent Releases of wannint
wannint - WannInt-v1.0.2
Fixes
- Singular value decomposition utility.
- Fortran
Published by irukoa about 1 year ago
wannint - WannInt-v1.0.1
New Features
- Matrix inversion utility.
- Fortran
Published by irukoa over 1 year ago
wannint - WannInt-v1.0.0
Features
- Definition and modifications at runtime of crystalline systems by tight-binding parameters.
- By direct user input.
- By WANNIER90 formatted files.
- Calculation of the Hamiltonian $H(\textbf{k})$ and Berry connection $A^j(\textbf{k})$.
- Arbitrary derivatives these quantities can be calculated and passed as MAC containers.
- OpenMP and SIMD instructions in the computation of Fourier sums.
- Wannier interpolation utilities:
- Dirac delta approximation,
- subspace degeneracy calculator,
- diagonalization utility,
- Schur decomposition utility,
- singular value decomposition utility,
- matrix exponential and logarithm utilities. ## Dependencies
- MAC ## Limitations
- FPM is the only supported build system.
- Fortran
Published by irukoa almost 2 years ago
wannint - WannInt-v1.0.0
Features
- Definition and modifications at runtime of crystalline systems by tight-binding parameters.
- By direct user input.
- By WANNIER90 formatted files.
- Calculation of the Hamiltonian $H(\textbf{k})$ and Berry connection $A^j(\textbf{k})$.
- Arbitrary derivatives these quantities can be calculated and passed as MAC containers.
- OpenMP and SIMD instructions in the computation of Fourier sums.
- Wannier interpolation utilities:
- Dirac delta approximation,
- subspace degeneracy calculator,
- diagonalization utility,
- Schur decomposition utility,
- singular value decomposition utility,
- matrix exponential and logarithm utilities. ## Dependencies
- MAC ## Limitations
- FPM is the only supported build system.
- Fortran
Published by irukoa almost 2 years ago
wannint - Version 0.1.0.
- Fully functional API.
- Add citation and badges.
- Fortran
Published by irukoa about 2 years ago
wannint - Initial release
Release to add zenodo DOI.
- Fortran
Published by irukoa about 2 years ago