ver.1.0 was released！

Please download abics-v1.0.0.tar.gz (not "Source code") because this file contains manual-pdf files

Main script abics
- new feature
  - Structure optimization
  - Reload the structure and temperature of the last step of the last simulation, and restart Monte Carlo sampling (reload)
  - Sequentially invoke the solver using multiple baseinput files while inheriting the structure(multistep)
Library
- OpenMX is now supported
- For QE, how to split CPU cores is now specified (so-called parallel levels)
- A bug that on reload the first structure of the second simulation was the same as the last structure of the first simulation is fixed
- Docstrings (API reference) are added
- Unittests are added
Utility tools
- st2abics is added
  - A tool for converting a structure file such as POSCAR and CIF file to the structure data for abICS
- abicsRXsepT is added
  - A tool for generating the result for each temperature from the result of each replica

Main script abics
- Sequentially invoke the solver using multiple baseinput files while inheriting the structure(multistep)
Library
- For QE, how to split CPU cores is now specified (so-called parallel levels)
- Now perturb only coordinates to be optimized
  - Fixed an error termination bug of the restart calculation using seldyn (changed to skip the process of recalculating the previous last structure when restarting).
Utility tools
- st2abics is added
  - A tool for converting a structure file such as POSCAR and CIF file to the structure data for abICS
- abicsRXsepT is added
  - A tool for generating the result for each temperature from the result of each replica