A new computational method allows modern atomic models to learn from experimental thermodynamic data, according to a University of Michigan Engineering and Université Paris-Saclay study published in ...

The arrangement of electrons in matter, known as the electronic structure, plays a crucial role in fundamental but also applied research such as drug design and energy storage. However, the lack of a ...

Crystallography is the science of analyzing the pattern produced by shining an X-ray beam through a material sample. A powder sample produces a different pattern than solid crystal. One longstanding ...

Empa researchers led by Simon Gramatte (front) and Vladyslav Turlo have succeeded for the first time in simulating amorphous aluminum oxide with hydrogen inclusions with atomic precision. Aluminum ...

Deep-Learning Paradigm Achieves Global Precision in Nuclear Charge Density PredictionsThe charge density distribution of an ...