Ab initio studies of the structural, dynamical and thermodynamical properties of graphitic and hydrogenated graphitic materials and their potential for hydrogen storage
Thesis
Khalil, R. Ab initio studies of the structural, dynamical and thermodynamical properties of graphitic and hydrogenated graphitic materials and their potential for hydrogen storage. (Thesis). Physics and Materials Research Centre

The study presented in this PhD thesis is related to exploration of the properties of graphitic materials within the frame-work of ab initio methods. Structural and dynamical properties of graphitic materials are evaluated using the ab initio p... Read More about Ab initio studies of the structural, dynamical and thermodynamical properties of graphitic and hydrogenated graphitic materials and their potential for hydrogen storage.