skip to main content
OSTI.GOV title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Hydrogen intercalation in MoS 2

Journal Article · · Physical Review B

Sponsoring Organization:
USDOE
Grant/Contract Number:
FG02-07ER46434; AC02-05CH11231
OSTI ID:
1306693
Journal Information:
Physical Review B, Journal Name: Physical Review B Vol. 94 Journal Issue: 8; ISSN 2469-9950
Publisher:
American Physical SocietyCopyright Statement
Country of Publication:
United States
Language:
English
Citation Metrics:
Cited by: 14 works
Citation information provided by
Web of Science

References (31)

Constructing metallic nanoroads on a MoS 2 monolayer via hydrogenation journal January 2014
Generalized Gradient Approximation Made Simple journal October 1996
First-principles study of van der Waals interactions in MoS 2 and MoO 3 journal July 2014
Projector augmented-wave method journal December 1994
Hybrid functionals based on a screened Coulomb potential journal May 2003
Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set journal July 1996
Design of electrocatalysts for oxygen- and hydrogen-involving energy conversion reactions journal January 2015
Electrostatic interactions between charged defects in supercells journal December 2010
Special points for Brillouin-zone integrations journal June 1976
Review of hydrogen storage techniques for on board vehicle applications journal November 2013
Electronics and optoelectronics of two-dimensional transition metal dichalcogenides journal November 2012
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set journal October 1996
Fully Ab Initio Finite-Size Corrections for Charged-Defect Supercell Calculations journal January 2009
Li adsorption, hydrogen storage and dissociation using monolayer MoS 2 : an ab initio random structure searching approach journal January 2015
The thermal expansion of 2 H -MoS 2 and 2 H -WSe 2 between 10 and 320 K journal June 1979
First-principles calculations for point defects in solids journal March 2014
Kramers-Kronig analysis of the reflectivity spectra of 2H-MoS 2 , 2H-MoSe 2 and 2H-MoTe 2 journal March 1979
Improved Description of the Structure of Molecular and Layered Crystals: Ab Initio DFT Calculations with van der Waals Corrections journal November 2010
Materials for Hydrogen Storage: Past, Present, and Future journal January 2011
Erratum: “Hybrid functionals based on a screened Coulomb potential” [J. Chem. Phys. 118, 8207 (2003)] journal June 2006
Atomically Thin MoS2 A New Direct-Gap Semiconductor journal September 2010
Semiempirical GGA-type density functional constructed with a long-range dispersion correction journal January 2006
A climbing image nudged elastic band method for finding saddle points and minimum energy paths journal December 2000
Elastic Constants and Pressure-Induced Effects in MoS 2 journal May 2014
Hydrogen adsorption on and diffusion through MoS2 monolayer: First-principles study journal October 2012
Improved tangent estimate in the nudged elastic band method for finding minimum energy paths and saddle points journal December 2000
Electrochemical Hydrogen Storage in MoS 2 Nanotubes journal November 2001
van der Waals Bonding in Layered Compounds from Advanced Density-Functional First-Principles Calculations journal June 2012
Single-layer MoS2 transistors journal January 2011
Universal alignment of hydrogen levels in semiconductors, insulators and solutions journal June 2003
Edge-terminated molybdenum disulfide with a 9.4-Å interlayer spacing for electrochemical hydrogen production journal July 2015

Similar Records

Adsorption, intercalation, diffusion, and adhesion of Cu at the 2 H Mo S 2 (0001) surface from first-principles calculations
Journal Article · Fri Feb 21 00:00:00 EST 2020 · Physical Review Research · OSTI ID:1306693

Nature and evolution of the band-edge states in MoS 2 : From monolayer to bulk
Journal Article · Mon Nov 17 00:00:00 EST 2014 · Physical Review B · OSTI ID:1306693

Sr2Ir1xRhxO4(x<0.5) : An inhomogeneous jeff=12 Hubbard system
Journal Article · Sat Aug 15 00:00:00 EDT 2015 · Physical Review. B, Condensed Matter and Materials Physics · OSTI ID:1306693

Related Subjects