ICON-EDiT

用於擴展Hueckel方法計算的經典程序。

Author of the code: Gion Calzaferri

Homepage: All the information about the code is presented in the project homepage. https://calzaferri.dcb.unibe.ch/program/iconedit.html

Source: Source code is available in the project homepage. https://calzaferri.dcb.unibe.ch/program/iconedit.html

Reference: Reference for the code - please see the project homepage.

https://calzaferri.dcb.unibe.ch/program/iconedit.html

Included database files were extended using following reference:

Alvarez, S.: Tables of parameters for extended Hückel calculations, Universitat de Barcelona 1989.

Description & Use:

ICON-EDiT performs extended Hückel calculations.

Quick start: check the included manuals

Program status:

The current package contains ICON-EDiT binaries of version `97 compiled for the particular Android hardware platforms and adapted for running in generic, stock devices. The app requires permission to access the file-storage. It works completely offline and does not contain ads.

License:

The distribution is published for free at Mobile Chemistry Portal and Google Play Store with kind permission of Gion Calzaferri.

For more details on licenses of used software, please check the included README file and the corresponding license files inside of the package.

Contact:

Compilation of the source code for Android/Windows as well as the Android/Windows app development was done by Alan Liška (alan.liska@jh-inst.cas.cz) and Veronika Růžičková (sucha.ver@gmail.com), J. Heyrovský Institute of Physical Chemistry of the CAS, v.v.i., Dolejškova 3/2155, 182 23 Praha 8, Czech Republic.

Website: http://www.jh-inst.cas.cz/~liska/MobileChemistry.htm