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@ss0832 ss0832 released this 27 Jan 09:58
· 36 commits to stable-v1.0 since this release
v1.3.1
f82e473
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Learn about vigilant mode.
  • Improved tangent ( J. Chem. Phys. 113, 9978–9985 (2000) ) for NEB method (-bneb)
  • Implementation of NEB method using Hessian (-fc, nebmain.py)
  • Fixing minor bugs
  • Refactoring
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