M Caragiu, S Finberg - Journal of Physics: Condensed Matter, 2005 - iopscience.iop.org
The adsorption of alkali metals on graphite has been the subject of various studies for the past two decades. Briefly, two main reasons can be offered to justify the persisting interest in …
KT Chan, JB Neaton, ML Cohen - Physical Review B—Condensed Matter and …, 2008 - APS
The adsorption of 12 different metal adatoms on graphene is studied using first-principles density-functional theory with the generalized gradient approximation. The adsorption …
We present detailed multifrequency resonant Raman measurements of potassium graphite intercalation compounds (GICs). From a well-controlled and consecutive in situ intercalation …
The structural, energetic, and electronic properties of the Li/graphite system are studied through density functional theory (DFT) calculations using both the local spin density …
Graphite intercalation compounds (GICs) are an interesting and highly studied field since 1970's. It has gained renewed interest since the discovery of superconductivity at high …
Z Xu, X Lv, J Chen, L Jiang, Y Lai, J Li - Carbon, 2016 - Elsevier
The first-principles calculations based on the density function theory (DFT) with the dispersion-corrected DFT-D2 method were performed to investigate the structure …
B Uchoa, CY Lin, AH Castro Neto - Physical Review B—Condensed Matter and …, 2008 - APS
We study the effects of metallic doping on the electronic properties of graphene using density functional theory in the local density approximation in the presence of a local …
D Lamoen, BNJ Persson - The Journal of chemical physics, 1998 - pubs.aip.org
We have performed electronic structure calculations of the interaction of potassium and oxygen with graphite (GR), individually and as coadsorbates. We use up to three graphite …
A Lugo-Solis, I Vasiliev - Physical Review B—Condensed Matter and Materials …, 2007 - APS
We present a first-principles study of potassium atom adsorption on graphene and carbon nanotubes. Our calculations are carried out using density functional theory combined with …