Accelerating rare events while overcoming the low-barrier problem using a temperature program

Accuracy of a Markov state model generated by searching for basin escape pathways

(2013) Vijesh J. Bhute et al.   JOURNAL OF CHEMICAL PHYSICS

Building a kinetic Monte Carlo model with a chosen accuracy

(2013) Vijesh J. Bhute et al.   JOURNAL OF CHEMICAL PHYSICS

A cluster expansion model for predicting activation barrier of atomic processes

(2013) Tafizur Rehman et al.   JOURNAL OF COMPUTATIONAL PHYSICS

A cluster expansion model for rate constants of surface diffusion processes on Ag, Al, Cu, Ni, Pd and Pt(100) surfaces

(2013) Sumit Verma et al.   SURFACE SCIENCE

Adaptive temperature-accelerated dynamics

(2011) Yunsic Shim et al.   JOURNAL OF CHEMICAL PHYSICS

Accurate acceleration of kinetic Monte Carlo simulations through the modification of rate constants

(2010) Abhijit Chatterjee et al.   JOURNAL OF CHEMICAL PHYSICS