Search Results - "Lima, Claudio Natalio"

Density functional study of adsorption of atoms and molecules on single-walled BN nanotubes by Lima, Claudio Natalio, Frota, H.O., Chaudhuri, Puspitapallab, Ghosh, Angsula

“…Density functional theory calculations have been used to investigate the adsorption of H atom and small molecules (H2, O2, N2, CO, CO2, NO and NO2) on the…”
Get full text

Density functional study of glycine adsorption on single-walled BN nanotubes by Chaudhuri, Puspitapallab, Lima, Claudio Natalio, Frota, H.O., Ghosh, Angsula

“…[Display omitted] •Adsorption of glycine molecule on the boron-nitrogen semiconducting nanotube through hydrogen bonding.•Armchair version of the nanotube…”
Get full text

First-principles study of nanotubes of carbon, boron and nitrogen by Chaudhuri, Puspitapallab, Lima, Claudio Natalio, Frota, H.O., Ghosh, Angsula

“…Density functional theory calculations are used to investigate a series of zigzag and armchair nanotubes of carbon, boron and nitrogen with various values of…”
Get full text

Encapsulation of atomic hydrogen and gaseous molecules in single-walled boron–nitrogen nanotubes: A computational study by Lima, Claudio Natalio, Frota, H.O., Chaudhuri, Puspitapallab, Ghosh, Angsula

“…First-principles calculations on the encapsulation of atomic hydrogen and some diatomic and triatomic molecules in single-walled (5,5) and (9,0) boron–nitrogen…”
Get full text

Structural, thermal and optical studies of nanocomposite powder NiSb + Sb produced by mechanical alloying by de Souza, Sérgio Michielon, da Silva, Gleison Adriano, Lima, Cláudio Natálio, Trichês, Daniela Menegon, Poffo, Cláudio Michel, de Lima, João Cardoso

“…A nanostructured composite powder formed from 75 wt.% NiSb and 25 wt.% Sb was obtained by mechanical alloying binary mixtures of elemental Ni and Sb powders in…”
Get full text