paper

The nature and strength of inter-layer binding in graphite

arXiv:0910.4983 · doi:10.1103/PhysRevLett.103.196401

Abstract

We computed the inter-layer bonding properties of graphite using an ab-initio many body theory. We carried out variational and diffusion quantum Monte Carlo calculations and found an equilibrium inter-layer binding energy in good agreement with most recent experiments. We also analyzed the behavior of the total energy as a function of interlayer separation at large distances comparing the results with the predictions of the random phase approximation.

5 pages; to appear in Phys. Rev. Lett

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