国家/地区 Usa（4） Austria（3） Brazil（2）
关键词 EXCITED STATE（2） GRAPHENE（2）
出版物 JOURNAL OF CHEMICAL.（3） ABSTRACTS OF PAPERS.（2） CHEMICAL PHYSICS（2）
出版时间 2019（4） 2015（3） 2014（2） 2017（2）
机构 TEXAS TECH U.（6） TIANJIN UNIV（2）
作者 LISCHKA H（13）

Theoretical analysis of the stabilization of graphene nanosheets by means of strongly polarized pyrene derivatives

CHEMICAL PHYSICS

SILVA NJ, BORGES I, TONE PA, GREEN MJ, LISCHKA H, AQUINO AJA

The characterization of electronic defect states of single and double carbon vacancies in graphene sheets using molecular density functional theory

MOLECULAR PHYSICS

PINHEIRO M, CARDOSO DVV, AQUINO AJA, MACHADO FBC, LISCHKA H

Carbon-based nanomaterials: From graphene sheets to carbon nanodots, and high-level theoretical studies

ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY

LISCHKA H

High-level theoretical benchmark investigations of the UV-vis absorption spectra of paradigmatic polycyclic aromatic hydrocarbons as models for graphene quantum dots

JOURNAL OF CHEMICAL PHYSICS

SHI BM, NACHTIGALLOVA D, AQUINO AJA, MACHADO FBC, LISCHKA H

The Diverse Manifold of Electronic States Generated by a Single Carbon Defect in a Graphene Sheet: Multireference Calculations Using a Pyrene Defect Model

CHEMPHYSCHEM

MACHADO FBC, AQUINO AJA, LISCHKA H

A comparison of singlet and triplet states for one- and two-dimensional graphene nanoribbons using multireference theory

THEORETICAL CHEMISTRY ACCOUNTS

HORN S, PLASSER F, MULLER T, LIBISCH F, BURGDORFER J, LISCHKA H

The Multiradical Character of One- and Two-Dimensional Graphene Nanoribbons

ANGEWANDTE CHEMIEINTERNATIONAL EDITION

PLASSER F, PASALIC H, GERZABEK MH, LIBISCH F, REITER R, BURGDORFER J, MULLER T, SHEPARD R, LISCHKA H

Structure and electronic states of a graphene double vacancy with an embedded Si dopant

JOURNAL OF CHEMICAL PHYSICS

NIEMAN R, AQUINO AJA, HARDCASTLE TP, KOTAKOSKI J, SUSI T, LISCHKA H

Single and double carbon vacancies in pyrene as first models for graphene defects: A survey of the chemical reactivity toward hydrogen

CHEMICAL PHYSICS

NIEMAN R, DAS A, AQUINO AJA, AMORIM RG, MACHADO FBC, LISCHKA H

Electronic states of carbon vacancy defects in graphene: A pyrene model

ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY

MACHADO F, AQUINO A, LISCHKA H