We added infos of a software for first principles calculations “Advance/PHASE” and an integrated G…Read More
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New apps: iqspr, COMBO, XenonPy
We added infos of three apps for machine learning techniques as follows: iqspr COMBO XenonPy Try these apps no…Read More
New app: k-ep
k-ep is a set of Fortran codes for computing the specified k-th eigenvalue and eigenvector for generalized sym…Read More
New Apps: Elastic
Elastic is a set of python routines for calculation of elastic properties of crystals (elastic constants, equa…Read More
New information: Libxc
Libxc is an library for exchange-correlation functions in the density functional theory. Detailed information …Read More
New information: mptensor, Tensordot, cuscalapack
Parallel C++ Library for tensor network methods mptensor, Automatic generation tool for codes of tensor contr…Read More
New information: CrySPY
CrySPY is a crystal structure prediction tool by utilizing first-principles calculations and a classical MD pr…Read More