Abstract We analyzed nanographite-based materials in a combined study including experimental analysis via 4-point probe STM and simulation to provide complete picture of microscopic macroscopic properties the material. The two- three-dimensional transport regimes were determined evaluated regarding anisotropy conductivity. results yield full conductivity tensor. Microstructural simulations are ...

• Reproduce experimental thermal conductivity using molecular dynamics. Shows how convergence factors impact calculated conductivity. Highlights the high degree of anisotropy in for Li 2 TiO 3 . The lithium metatitanate, , is shown classical simulation method Molecular Dynamics (MD). along z -direction markedly lower than that x and y This characteristic could be exploited fabrication breeder b...