A QUESTION of fundamental importance in the theory of the solid state is the nature of the arrangement of the ultimate particles in amorphous or vitreous bodies, of which glass is the most ...
Rice and colleagues also made the first quantum calculations of exciton-exciton annihilation in a molecular solid, and made seminal contributions to the theory of electronic states of molecular solids ...
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Liquid-like molecular dynamics explain solid-state battery material's superionic transport abilitiesWhile it is a solid at room temperatures, it still allows lithium ions to travel as quickly through its molecular structure as its liquid cousins. How and why these ions are able to do this ...
This project aims to predict the technical performance of solid adsorbents using advanced molecular modelling and simulation. In this way, we can give feedback to chemists carrying out synthesis of ...
and the Indian Institute of Technology Madras explores the adaptation of molecular-based frustrated Lewis pairs (FLPs) for solid-state systems. Development of a transition metal-free sodium-doped ...
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