Quantum KITE Initiative Creates Open-Source Software to Assist in Creation of Quantum Materials Capable of Delivering Intense Computing Power

(Phys.org) A research collaboration led by the University of York’s Department of Physics has created open-source software to assist in the creation of quantum materials which could in turn vastly increase the world’s computing power.
Data centres and cloud computing are consuming growing amounts of energy—quantum materials could help tackle this problem, say the researchers. The design of quantum materials capable of delivering intense computing power is guided by sophisticated computer programmes capable of predicting how materials behave when ‘excited’ with currents and light signals.
Computational modelling has now taken a ‘quantum leap’ forward with the announcement of the Quantum KITE initiative, a suite of open-source computer codes developed by researchers in Brazil, the EU and the University of York. KITE is capable of simulating realistic materials with unprecedented numbers of atoms, making it ideally suited to create and optimise quantum materials for a variety of energy and computing applications.