surface hopping造句
例句與造句
- He is known for his development of surface hopping, a method for including excited states in molecular dynamics calculations.
- Surface hopping accounts for these limitations by propagating an ensemble of trajectories, each one of them on a single adiabatic surface at any given time.
- Surface hopping can develop nonphysical coherences between the quantum coefficients over large time which can degrade the quality of the calculations, at times leading the incorrect scaling for Marcus theory.
- In this approach, the key quantity for computation of the surface hopping probability, the inner product between the nonadiabatic couplings ( "'& tau; "'
- "' SHARC "'( "'Surface Hopping including ARbitrary Couplings "') is an ab initio molecular dynamics program suite primarily dedicated to study the excited-state dynamics of molecules.
- It's difficult to find surface hopping in a sentence. 用surface hopping造句挺難的
- "' Newton-X "'uses the trajectory surface hopping method, a semi-classical approximation in which the nuclei are treated classically by Newtonian dynamics, while the electrons are treated as a quantum subsystem via a local approximation of the potential energy states during the dynamics.