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Top 7.1% on spack.io

spack.io : bigdft-atlab

BigDFT-atlab: library for ATomic related operations.

Registry - Source - JSON
purl: pkg:spack/bigdft-atlab
License: Other
Latest release: about 2 years ago
First release: about 2 years ago
Dependent packages: 3
Last synced: 28 days ago

py-bigdft 1.9.2
BigDFT: the python interface of BigDFT for electronic structure calculation based on Daubechies w...
4 versions - Latest release: about 2 years ago - 1 dependent package - 1 maintainer
libgain 1.0.0
GaIn is intended to provide routines with a relatively simple interface for calculation of overla...
1 version - Latest release: about 2 years ago - 1 dependent package
bigdft-suite 1.9.2
BigDFT-suite: the complete suite of BigDFT for electronic structure calculation based on Daubechi...
7 versions - Latest release: about 2 years ago
bigdft-spred 1.9.2
BigDFT-spred: a library for structure prediction tools, that is compiled on top of BigDFT routines.
7 versions - Latest release: about 2 years ago - 1 dependent package
Top 7.1% on spack.io
bigdft-psolver 1.9.2
BigDFT-Psolver: a flexible real-space Poisson Solver based on Interpolating Scaling Functions. It...
7 versions - Latest release: about 2 years ago - 3 dependent packages
Top 9.5% on spack.io
bigdft-libabinit 1.9.2
BigDFT-libABINIT: this is a subsection of files coming from ABINIT software package, to which Big...
7 versions - Latest release: about 2 years ago - 2 dependent packages
Top 3.3% on spack.io
bigdft-futile 1.9.2
BigDFT-futile: a library handling most common FORTRAN low-level operations, like memory managment...
7 versions - Latest release: about 2 years ago - 8 dependent packages
Top 9.5% on spack.io
bigdft-core 1.9.2
BigDFT-core: the core components of BigDFT, an electronic structure calculation based on Daubechi...
7 versions - Latest release: about 2 years ago - 2 dependent packages
Top 9.5% on spack.io
bigdft-chess 1.9.2
BigDFT-CheSS: A module for performing Fermi Operator Expansions via Chebyshev Polynomials.
7 versions - Latest release: about 2 years ago - 2 dependent packages