国家/地区 China（3） Mexico（3） Chile（2）
关键词 GRAPHENE OXIDE（13）
出版物 JOURNAL OF MOLECULAR MODELING（13）
出版时间 2013（4） 2020（4）
机构 BENEMERITA U.（2） UNIV SANTIAG.（2）
作者 ANOTA EC（2） ESCOBEDOMORA.（2）

Gas separation using graphene nanosheet: insights from theory and simulation

JOURNAL OF MOLECULAR MODELING

FATEMI SM, FATEMI SJ, ABBASI Z

A density functional theory study of simplest nanocomposites formed by graphene oxide and polyvinyl alcohol: geometry, interaction energy and vibrational spectrum

JOURNAL OF MOLECULAR MODELING

GORB L, ILCHENKO M, LESZCZYNSKI J

Theoretical study of ciprofloxacin antibiotic trapping on graphene or boron nitride oxide nanoflakes

JOURNAL OF MOLECULAR MODELING

DUVERGER E, PICAUD F

Theoretical study of glycine amino acid adsorption on graphene oxide

JOURNAL OF MOLECULAR MODELING

ROSSIFERNANDEZ AC, VILLEGASESCOBAR N, GUZMANANGEL D, GUTIERREZOLIVA S, FERULLO RM, CASTELLANI NJ, TOROLABBE A

Insight into hydrogen bonds and characterization of interlayer spacing of hydrated graphene oxide

JOURNAL OF MOLECULAR MODELING

LIU LY, ZHANG RF, LIU Y, TAN W, ZHU GR

Modeling the physisorption of bisphenol A on graphene and graphene oxide

JOURNAL OF MOLECULAR MODELING

CORTESARRIAGADA D, SANHUEZA L, SANTANDERNELLI M

Molecular vibrational spectroscopy characterization of epoxy graphene oxide from density functional calculations

JOURNAL OF MOLECULAR MODELING

LIU B, SUN HJ, PENG TJ, JI GF

On the influence of point defects on the structural and electronic properties of graphene-like sheets: a molecular simulation study

JOURNAL OF MOLECULAR MODELING

ANOTA EC, ESCOBEDOMORALES A, VILLANUEVA MS, VAZQUEZCUCHILLO O, ROSAS ER

Global and local reactivity indexes applied to understand the chemistry of graphene oxide and doped graphene

JOURNAL OF MOLECULAR MODELING

ARRIAGADA DC

First principles calculations of the electronic and chemical properties of graphene, graphane, and graphene oxide

JOURNAL OF MOLECULAR MODELING

ROSAS JJH, GUTIERREZ RER, ESCOBEDOMORALES A, ANOTA EC