The CP2K open-source package is among the top three most widely used research software suites worldwide for simulating the ...

A research team affiliated with UNIST has reported a new simulation tool to better understand how liquid-phase chemical warfare agents (CWAs) disperse and persist in urban environments. Their findings ...

Researchers have made a meaningful advance in the simulation of molecular electron transfer -- a fundamental process underpinning countless physical, chemical and biological processes. The study ...

Scientists made a twin version of our universe, showing the evolution of all forms of matter and energy, in the biggest cosmological computer simulation to date. When you purchase through links on our ...

The built environment faces increasing pressures from climate change, resource limitations, and rapid urbanisation.