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v2.0.0-beta.1

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@amcadmus amcadmus released this 03 Jun 08:14
· 1769 commits to devel since this release
v2.0.0.b1
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Learn about vigilant mode.

New hardware support:

  • ROCM support

Enhancement:

  • Document and examples for the C++ interface
  • Instructions for the i-pi
  • Document for the network size and sel

Bug fixing:

  • Illegal nlist #680
  • Bug in prod_virial_grad that causes wrong results when training with virials #685
  • Uniform random seed #691
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