aufbau / Blog: Recent posts

The Project has now a mailing list! You can subscribe to it by clicking here!

The mailing list will inform you about new stable releases of aufbau!

The main goals for version 1.5 are:

1. Replacement of arrays with vectors. As a result, the input of electrons will not be limited.
2. Calculation of electron-capacity only for those orbitals needed, which will result in speed and memory usage inprovements. DONE

Version 1.0 is here!
Download it, enjoy it, modify it and reshare it.
But please respect gpl license. Info here:
http://www.gnu.org/licenses/quick-guide-gplv3.html
Greetings
Manos

Launched today this new project, named "aufbau". Being a student i was bored of doing all the hard work in chemistry, so the computer took over!
The purpose of "aufbau" is to create electron configuration of an atom following the "Aufbau" Principle.
I am writing code in c++.
Greetings
Manos