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ChangeLog.md

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Change log {#changelog}

open-Qmin version 0.10

  • Add Python "helper" scripts for boundaries, initialization, and command-line parameters
  • Introduce web documentation
  • Automatically detect number of elastic energy terms in use

OpenQMin version 0.9 -- in progress

  • Switch to GUI initialization according to Frank constants rather than landau-deGennes ones
  • Corrections to the metric used to compute forces in the non-orthogonal basis of Qxx, Qxy, Qxz, Qyy, Qyz
  • Update to CMAKE files in response to community feedback
  • Substantial command-line improvements and user-friendliness

OpenQMin version 0.8

  • Extensive minor improvements in advance of paper submission
  • Creation of noQT branch to maintain a version without the QT dependency
  • Slight change to the logic of distortion energy when more than L1 is used

landauDeGUI version 0.7

  • multi-rank simulations possible via openMPI functionality

landauDeGUI version 0.6

  • various boundary conditions implemented
  • 1- 2- and 3- constant approximation to the distortion term implemented
  • semi-reasonable visualizations added

landauDeGUI version 0.5

  • functional Q-tensor on a cubic lattice solver
  • QT-based GUI

dDimensionalSimulation version 0.1

  • hypercubic celllist and neighbor list implemented
  • d-dimensional simulations of simple pairwise potentials
  • fixed-topology interactions permitted
  • nve, nvt, and energy minimization enabled
  • compile-time setting of dimensionality via root CMakeLists.txt file