Jones, die in Gelsenkirchen wohnt und dort eine Medienagentur betreibt, wird damit Nachfolgerin von Youri Mulder.

Electronic-structure theory is the foundation of the description of materials including multiscale modeling of their properties and functions. Obviously, without sufficient accuracy at the base, relia...

We describe a theoretical and computational approach to calculate the vibrational, elastic, and thermal properties of materials from the low-temperature quantum