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update CHANGELOG.md for v2.0a1
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bpuchala committed Jul 17, 2024
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Expand Up @@ -6,7 +6,7 @@ The format is based on [Keep a Changelog](https://keepachangelog.com/en/1.1.0/),
and this project adheres to [Semantic Versioning](https://semver.org/spec/v2.0.0.html).


## [v2.0a1] - Unreleased
## [2.0a1] - 2024-07-17

This release creates the libcasm-clexmonte cluster expansion based Monte Carlo module. It includes:

Expand All @@ -15,11 +15,6 @@ This release creates the libcasm-clexmonte cluster expansion based Monte Carlo m
- Metropolis and N-fold way implementations
- Support for customizing sampling and analysis functions

The distribution package libcasm-clexmonte contains several Python packages of use for configuration comparison and enumeration:

- libcasm.clexmonte.canonical
- libcasm.clexmonte.semigrand_canonical
- libcasm.kinetic
- TODO
The distribution package libcasm-clexmonte contains a Python package (libcasm.clexmonte) that provides an interface to Monte Carlo simulation methods implemented in C++. The libcasm.clexmonte.MonteCalculator class currently provides access to simulations in the canonical and semi-grand canonical ensemble and will be expanded in the next releases to include additional methods.

This package may be installed via pip install, using scikit-build, CMake, and pybind11. This release also includes usage examples and API documentation, built using Sphinx.

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