2009

"ReaxFF Molecular Dynamics Simulation of Thermal Stability of a Cu3(BTC)2 Metal-Organic Framework"
Liangliang Huang, Kaushik L. Joshi, Adri C. T. van Duin, Teresa J. Bandosz, and Keith E. Gubbins
Physical Chemistry Chemical Physics, 2012, 14, 11327-11332.