ABSTRACT

Radiation probes such as neutrons, x-rays and visible light are used to ‘see’ the structure of physical systems through elastic scattering experiments. Inelastic scattering experiments measure both the structural and dynamical correlations that exist in a physical system. For a system which is in thermodynamic equilibrium, themolecular dynamics create spatio-temporal correlationswhich are themanifestation of thermal fluctuations around the equilibrium state. For a condensed phase system, dynamical correlations are intimately linked to its structure. For systems in equilibrium, linear response theory is an appropriate framework to use to inquire on the spatio-temporal correlations resulting from thermodynamic fluctuations. Appropriate response and correlation functions emerge naturally in this framework, and the role of theory is to understand these correlation functions from first principles. This is the subject of section A3.3.2.