相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。Density functional study of the adsorption and van der Waals binding of aromatic and conjugated compounds on the basal plane of MoS2
Poul Georg Moses et al.
JOURNAL OF CHEMICAL PHYSICS (2009)
Ferromagnetism in armchair graphene nanoribbons
Hsiu-Hau Lin et al.
PHYSICAL REVIEW B (2009)
Magnetic molybdenum disulfide nanosheet films
Jia Zhang et al.
NANO LETTERS (2007)
Location and coordination of promoter atoms in Co- and Ni-promoted MoS2-based hydrotreating catalysts
Jeppe V. Lauritsen et al.
JOURNAL OF CATALYSIS (2007)
The hydrogenation and direct desulfurization reaction pathway in thiophene hydrodesulfurization over MoS2 catalysts at realistic conditions:: A density functional study
Poul Georg Moses et al.
JOURNAL OF CATALYSIS (2007)
A density functional theory study of the hydrogenolysis and elimination reactions of C2H5SH on the catalytically active (100) edge of 2H-MoS2
Teodora Todorova et al.
JOURNAL OF CATALYSIS (2007)
Electronic structure and stability of semiconducting graphene nanoribbons
Veronica Barone et al.
NANO LETTERS (2006)
Energy gaps in graphene nanoribbons
Young-Woo Son et al.
PHYSICAL REVIEW LETTERS (2006)
A fast and robust algorithm for Bader decomposition of charge density
Graeme Henkelman et al.
COMPUTATIONAL MATERIALS SCIENCE (2006)
Adsorption and dissociation of H2 and H2S on MoS2 and NiMoS catalysts
MY Sun et al.
CATALYSIS TODAY (2005)
Atomic structures and magnetism in small MoS2 and WS2 clusters -: art. no. 063203
P Murugan et al.
PHYSICAL REVIEW A (2005)
Biornimetic hydrogen evolution:: MoS2 nanoparticles as catalyst for hydrogen evolution
B Hinnemann et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2005)
Substrate interactions with the nitrogenase active site
PC Dos Santos et al.
ACCOUNTS OF CHEMICAL RESEARCH (2005)
A density functional study of the chemical differences between type I and type II MOS2-based structures in hydrotreating catalysts
B Hinnemann et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2005)
Atomic-scale insight into structure and morphology changes of MoS2 nanoclusters in hydrotreating catalysts
JV Lauritsen et al.
JOURNAL OF CATALYSIS (2004)
On the incorporation of nickel and cobalt into MoS2-edge structures
MY Sun et al.
JOURNAL OF CATALYSIS (2004)
Structure of the FeFe-cofactor of the iron-only nitrogenase and possible mechanism for dinitrogen reduction
B Hinnemann et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2004)
Ab initio study of MoS2 nanotube bundles -: art. no. 045423
M Verstraete et al.
PHYSICAL REVIEW B (2003)
Magnetic properties of MoS2 nanotubes doped with lithium
Z Jaglicic et al.
POLYHEDRON (2003)
Vacancy formation on MoS2 hydrodesulfurization catalyst:: DFT study of the mechanism
JF Paul et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2003)
Chemistry of one-dimensional metallic edge states in MoS2 nanoclusters
JV Lauritsen et al.
NANOTECHNOLOGY (2003)
Atomic and electronic structure of MoS2 nanoparticles -: art. no. 085410
MV Bollinger et al.
PHYSICAL REVIEW B (2003)
An object-oriented scripting interface to a legacy electronic structure code
SR Bahn et al.
COMPUTING IN SCIENCE & ENGINEERING (2002)
Shape and edge sites modifications of MoS2 catalytic nanoparticles induced by working conditions:: A theoretical study
H Schweiger et al.
JOURNAL OF CATALYSIS (2002)
Band structure of MoS2, MoSe2, and α-MoTe2:: Angle-resolved photoelectron spectroscopy and ab initio calculations -: art. no. 235305
T Böker et al.
PHYSICAL REVIEW B (2001)
One-dimensional metallic edge states in MoS2 -: art. no. 196803
MV Bollinger et al.
PHYSICAL REVIEW LETTERS (2001)
Direct observation of graphite layer edge states by scanning tunneling microscopy
PL Giunta et al.
JOURNAL OF CHEMICAL PHYSICS (2001)
Atomic-scale structure of Co-Mo-S nanoclusters in hydrotreating catalysts
JV Lauritsen et al.
JOURNAL OF CATALYSIS (2001)
Thin films of fullerene-like MoS2 nanoparticles with ultra-low friction and wear
M Chhowalla et al.
NATURE (2000)
Atomic-scale structure of single-layer MoS2 nanoclusters
S Helveg et al.
PHYSICAL REVIEW LETTERS (2000)
Ab initio study of the H-2-H2S/MoS2 gas-solid interface: The nature of the catalytically active sites
P Raybaud et al.
JOURNAL OF CATALYSIS (2000)