
United Natural EXperiments (UNEX) 1.5.0 release
User's manual

Table of contents
- Introduction.
- Basic theses.
- The goals of program development.
- Current possibilities.
- Conditions of program usage.
- If you found error.
- Working with program.
- Installation.
- Basics of usage.
- How to make the input file.
- Philosophy of the base information entering.
- BASE field.
- Molecular information entering.
- Image files entering.
- Molecular geometry entering.
- Mean square amplitudes and vibrational corrections entering.
- The entering of a full information about GED terms of molecule.
- GED g-functions entering.
- The entering of the intensity and sM(s) curves.
- Potential functions entering.
- GED sector function entering.
- Scanner calibration curve entering.
- Molecular force fields entering.
- The work with electron scattering intensity curves.
- Background line estimation.
- Background line estimation with correction by difference curve.
- Background line estimation using sector function.
- Averaging of different curves.
- Averaging of the intensity curves.
- Averaging of the experimental sM(s) curves.
- Calculation of the Fourier transforms of sM(s) curves.
- Searching of the optimal solutions of reverse problems.
- Basics.
- Reverse problem in GED.
- Determination of the molecular geometry from rotational constants.
- Combined GED+MW reverse problem.
- Initial processing of the GED experimental material.
- Scanning.
- Scanner calibration.
- Transformation of the diffraction patterns to intensity curves.
- Estimation of the electron wavelength and sector function.
- Thermodynamics.
- Statistical thermodynamics.
- Useful.
- Printing the different data.
- Additional work with images.
- Automatic dividing of the mean square amplitudes to groups.
- Other useful commands.
- Examples of program usage.
- Results of tests.
- History of program changing.
- Questions and answers.
- References.

11.02.2007
Yura Vishnevskiy
y_v_vishnevsky@rambler.ru