When atoms are put together to form a three-dimensional substance, the properties of the substance are governed by how quantum clouds of electrons, the orbitals, move around and interact with each ...

At Heidelberg University, an interdisciplinary research project titled “Quantum Chemistry without Orbitals” is underway, funded by over 745,0 ...

The motion of the selenium atoms (red) changes the energy of the electron orbitals of the iron atoms (blue), and the resulting electron vibrations are recorded separately with a technique called ...

Artificial intelligence methods are to assist in predicting the kinetic energy of electrons in molecules based on their electron density. That is the concern of an interdisciplinary research project ...