UNEXTitle

UNEX is a programming environment for investigation of molecular structure. We develop new and existing experimental methods and combine them to increase accuracy and precision of results. At the current stage the full support of gas electron diffraction (GED) investigations is provided, from the calibration of instruments and data reduction to the refinement of molecular structure. Additionally, rotational constants can be used solely or in combination with GED data for determination of molecular geometry.

Cite UNEX as

Recent activity

UNEX 1.6

2020-02-17:  Introduced and documented molx
2020-02-17:  Docs updated
2020-02-13:  IntPlot: added options xmin and xmax
2020-02-11:  Updated docs
2020-02-11:  Regularization parameters are correctly ignored if needed
2020-02-06:  Docs updated
2020-02-06:  Fixed recalculation of scattering factors
2020-02-05:  Implemented updating group numbers for r_a and amplitudes
2020-02-05:  Manual updated
2020-02-04:  Implemented unconditional jumps using GOTO and LABEL

UNEX 2.0

2020-01-24:  Fixed in-source starting scripts for macOS
2020-01-23:  Use universal starting script in *NIX
2020-01-22:  In update script for *NIX curl can be used
2020-01-18:  Implemented FVector#eq_eps
2020-01-18:  Docs updated
2020-01-18:  Docs added
2020-01-16:  Testing and documenting MPI::barrier
2020-01-15:  Refined testing script for Windows
2020-01-15:  Finished migration to ULTW
2020-01-14:  Uptest: fixed docs dir for UNEX1
UNEX@SomoniPeak
UNEX and its main developer Yury Vishnevskiy (on the right) at the top of Ismoil Somoni Peak (7495 m) on Aug 9, 2017.