Theoretical physicist Moumita Maiti and colleagues at the Jawaharlal Nehru Centre for Advanced Scientific Research in Bangalore, India, have now implemented an algorithm for analysing void space in ...

In recent years, research and development on quantum computers has made considerable progress. Quantum chemical calculations for electronic structures of atoms and molecules are attracting great ...

"Gap geometry grasped: New algorithm elucidates structure of liquids and how they flow through porous media." ScienceDaily. www.sciencedaily.com / releases / 2013 / 02 / 130201090403.htm (accessed ...

"Quantum algorithm of the direct calculation of energy derivatives developed for molecular geometry optimization." ScienceDaily. www.sciencedaily.com / releases / 2022 / 11 / 221129112741.htm ...