60 citations · 91 across the 2 of their papers we have counts for
2 papers
physics.chem-ph2017★ 31 cited
Effect of Li Termination on the Electronic and Hydrogen Storage Properties of Linear Carbon Chains: A TAO-DFT Study
Sonai Seenithurai, Jeng-Da Chai
Accurate prediction of the electronic and hydrogen storage properties of linear carbon chains (Cn) and Li-terminated linear carbon chains (Li2Cn), with n carbon atoms (n = 5 - 10),…
physics.chem-ph2016★ 60 cited
Effect of Li Adsorption on the Electronic and Hydrogen Storage Properties of Acenes: A Dispersion-Corrected TAO-DFT Study
Sonai Seenithurai, Jeng-Da Chai
Due to the presence of strong static correlation effects and noncovalent interactions, accurate prediction of the electronic and hydrogen storage properties of Li-adsorbed acenes w…