Quantum dynamics and semiclassical approaches constitute a vital area of contemporary research in molecular science, offering powerful tools to decipher the complex interplay between quantum effects ...

For almost as long as Lawrence Livermore has existed, scientists have been experimenting with materials to learn what happens to them under high pressure. In the brief instant of a high-explosive ...

The 2024 Gordon Bell Prize goes to researchers led by the University of Melbourne for using the Frontier supercomputer to conduct a quantum molecular dynamics simulation 1,000 times greater in size ...

(Nanowerk News) Quantum spin liquids (QSLs) are fascinating and mysterious states of matter that have intrigued scientists for decades. First proposed by Nobel laureate Philip Anderson in the 1970s, ...

Researchers have implemented a quantum-based method to observe a quantum effect in the way light-absorbing molecules interact with incoming photons. Known as a conical intersection, the effect puts ...

Quantum spin liquids are fascinating states of matter where magnetic spins stay disordered, defying the usual rules of magnetism. Scientists have made an exciting discovery about one such material.

A research team from the Innovation Academy for Precision Measurement Science and Technology (APM) of the Chinese Academy of ...

Molecular Dynamics Simulations are grounded in classical mechanics, particularly Newton’s laws of motion, to predict how particles move within a system. The force acting on each atom is calculated ...

AI, ML, and statistical algorithms guide solubilization method selection, demonstrated with compound CVN424. In a poster presentation at AAPS PharmSci 360, by Dineli Ranathunga, PhD, indicates that AI ...