Mass-stat

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A Mass-stat can be used to introduce or remove particles during a molecular dynamics calculation.

USHER mass-stat

[1][2]

FADE mass-stat

[3]

See also

References

  1. ↑ Rafael Delgado-Buscalioni and Peter V. Coveney "USHER: An algorithm for particle insertion in dense fluids", Journal of Chemical Physics 119 pp. 978-987 (2003)
  2. ↑ Gianni De Fabritiis, Rafael Delgado-Buscalioni and Peter V. Coveney "Energy controlled insertion of polar molecules in dense fluids", Journal of Chemical Physics 121 12139 (2004)
  3. ↑ Matthew K. Borg, Duncan A. Lockerby and Jason M. Reese "The FADE mass-stat: A technique for inserting or deleting particles in molecular dynamics simulations", Journal of Chemical Physics 140 074110 (2014)
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