国家/地区 Mexico（4）
关键词 GRAPHENE（3） ADSORPTION（2） DENSITY FUNCTIONAL .（2）
出版物 COMPUTATIONAL THEOR.（2） JOURNAL OF MOLECULA.（2）
出版时间 2022（2）
机构
作者 DE LA CRUZ MTR（4）

Studies of hydrogen sulfide and ammonia adsorption on P- and Si-doped graphene: density functional theory calculations

JOURNAL OF MOLECULAR MODELING

PADILLA VEC, DE LA CRUZ MTR, ALVARADO YEA, DIAZ RG, GARCIA CER, COCOLETZI GH

First principles studies of the graphene-phenol interactions

JOURNAL OF MOLECULAR MODELING

HERNANDEZ JMG, ANOTA EC, DE LA CRUZ MTR, MELCHOR MG, COCOLETZI GH

Adsorption of acetic acid and benzoic acid on pristine and defect containing graphene: A DFT study

COMPUTATIONAL THEORETICAL CHEMISTRY

ESCARENO AA, PAEZORNELAS JI, GUERREROSANCHEZ J, SAENZGALINDO A, GARCIADIAZ R, GALLARDOVEGA C, OCHOAVALIENTE R, DE LA CRUZ MTR

Efficient NO2 removal induced by transition-metal doped and co-doped graphene: An ab-initio study

COMPUTATIONAL THEORETICAL CHEMISTRY

CAMARILLOSALAZAR E, GARCIADIAZ R, AVILAALVARADO Y, GUERREROSANCHEZ J, COCOLETZI GH, DE LA CRUZ MTR