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

Title: On sulfur core level binding energies in thiol self-assembly and alternative adsorption sites: An experimental and theoretical study

Authors:
 [1]; ORCiD logo [2];  [3];  [4];  [4];  [5]
  1. Institut des Sciences Moléculaires d’Orsay, Université-Paris Sud, 91405 Orsay, France, CNRS, UMR 8214, Institut des Sciences Moléculaires d’Orsay, Orsay ISMO, Bâtiment 351, Université Paris Sud, 91405 Orsay, France
  2. Department of Physics, University of Central Florida, Orlando, Florida 32816, USA
  3. Dipartimento di Ingegneria “E. Ferrari,” Università di Modena e Reggio Emilia, Via Vignolese 905, 41125 Modena, Italy, IOM-CNR, s.s. 14, Km. 163.5 in AREA Science Park, 34149 Basovizza, Trieste, Italy, Department of Physics, University of Johannesburg, P.O. Box 524, Auckland Park 2006, South Africa
  4. Synchrotron SOLEIL, L’Orme des Merisiers, Saint-Aubin, BP 48, F-91192 Gif-sur-Yvette Cedex, France
  5. Institut des Sciences Moléculaires d’Orsay, Université-Paris Sud, 91405 Orsay, France, CNRS, UMR 8214, Institut des Sciences Moléculaires d’Orsay, Orsay ISMO, Bâtiment 351, Université Paris Sud, 91405 Orsay, France, IOM-CNR, s.s. 14, Km. 163.5 in AREA Science Park, 34149 Basovizza, Trieste, Italy
Publication Date:
Sponsoring Org.:
USDOE
OSTI Identifier:
1229660
Grant/Contract Number:  
FG02-11ER16243; SC0007045
Resource Type:
Publisher's Accepted Manuscript
Journal Name:
Journal of Chemical Physics
Additional Journal Information:
Journal Name: Journal of Chemical Physics Journal Volume: 143 Journal Issue: 10; Journal ID: ISSN 0021-9606
Publisher:
American Institute of Physics
Country of Publication:
United States
Language:
English

Citation Formats

Jia, Juanjuan, Kara, Abdelkader, Pasquali, Luca, Bendounan, Azzedine, Sirotti, Fausto, and Esaulov, Vladimir A. On sulfur core level binding energies in thiol self-assembly and alternative adsorption sites: An experimental and theoretical study. United States: N. p., 2015. Web. doi:10.1063/1.4929350.
Jia, Juanjuan, Kara, Abdelkader, Pasquali, Luca, Bendounan, Azzedine, Sirotti, Fausto, & Esaulov, Vladimir A. On sulfur core level binding energies in thiol self-assembly and alternative adsorption sites: An experimental and theoretical study. United States. doi:10.1063/1.4929350.
Jia, Juanjuan, Kara, Abdelkader, Pasquali, Luca, Bendounan, Azzedine, Sirotti, Fausto, and Esaulov, Vladimir A. Mon . "On sulfur core level binding energies in thiol self-assembly and alternative adsorption sites: An experimental and theoretical study". United States. doi:10.1063/1.4929350.
@article{osti_1229660,
title = {On sulfur core level binding energies in thiol self-assembly and alternative adsorption sites: An experimental and theoretical study},
author = {Jia, Juanjuan and Kara, Abdelkader and Pasquali, Luca and Bendounan, Azzedine and Sirotti, Fausto and Esaulov, Vladimir A.},
abstractNote = {},
doi = {10.1063/1.4929350},
journal = {Journal of Chemical Physics},
number = 10,
volume = 143,
place = {United States},
year = {2015},
month = {9}
}

Journal Article:
Free Publicly Available Full Text
Publisher's Version of Record
DOI: 10.1063/1.4929350

Citation Metrics:
Cited by: 7 works
Citation information provided by
Web of Science

Save / Share:

Works referenced in this record:

Metal nanoparticles and their assemblies
journal, January 2000

  • Rao, C. N. Ramachandra; Kulkarni, Giridhar U.; Thomas, P. John
  • Chemical Society Reviews, Vol. 29, Issue 1
  • DOI: 10.1039/a904518j

Generalized Gradient Approximation Made Simple
journal, October 1996

  • Perdew, John P.; Burke, Kieron; Ernzerhof, Matthias
  • Physical Review Letters, Vol. 77, Issue 18, p. 3865-3868
  • DOI: 10.1103/PhysRevLett.77.3865

Adsorption geometry variation of 1,4-benzenedimethanethiol self-assembled monolayers on Au(111) grown from the vapor phase
journal, April 2008

  • Pasquali, L.; Terzi, F.; Seeber, R.
  • The Journal of Chemical Physics, Vol. 128, Issue 13
  • DOI: 10.1063/1.2876118

Modification of self-assembled monolayers of alkanethiols on gold by ionizing radiation
journal, August 1997

  • Wirde, Mikael; Gelius, Ulrik; Dunbar, Tim
  • Nuclear Instruments and Methods in Physics Research Section B: Beam Interactions with Materials and Atoms, Vol. 131, Issue 1-4
  • DOI: 10.1016/s0168-583x(97)00140-7

Substitutional Self-Assembly of Alkanethiol and Selenol SAMs from a Lying-Down Doubly Tethered Butanedithiol SAM on Gold
journal, August 2011

  • Chaudhari, Vijay; Kotresh, Harish Makri Nimbegondi; Srinivasan, Sampath
  • The Journal of Physical Chemistry C, Vol. 115, Issue 33
  • DOI: 10.1021/jp2042922

Chain-Length-Dependent Branching of Irradiation-Induced Processes in Alkanethiolate Self-Assembled Monolayers
journal, December 2010

  • Hamoudi, H.; Chesneau, F.; Patze, C.
  • The Journal of Physical Chemistry C, Vol. 115, Issue 2
  • DOI: 10.1021/jp109434k

High Resolution X-ray Photoelectron Spectroscopy Measurements of Octadecanethiol Self-Assembled Monolayers on Au(111)
journal, April 1998

  • Ishida, Takao; Hara, Masahiko; Kojima, Isao
  • Langmuir, Vol. 14, Issue 8
  • DOI: 10.1021/la971104z

Solvent-Dependent Assembly of Terphenyl- and Quaterphenyldithiol on Gold and Gallium Arsenide
journal, June 2005

  • Krapchetov, Dmitry A.; Ma, Hong; Jen, Alex K. Y.
  • Langmuir, Vol. 21, Issue 13
  • DOI: 10.1021/la0503000

Self-Assembly of Alkanedithiols on Au(111) from Solution: Effect of Chain Length and Self-Assembly Conditions
journal, November 2009

  • Millone, María Antonieta Daza; Hamoudi, Hicham; Rodríguez, Luis
  • Langmuir, Vol. 25, Issue 22
  • DOI: 10.1021/la901601z

Decomposition of Methylthiolate Monolayers on Au(111) Prepared from Dimethyl Disulfide in Solution Phase
journal, May 2010

  • Cometto, F. P.; Macagno, V. A.; Paredes-Olivera, P.
  • The Journal of Physical Chemistry C, Vol. 114, Issue 22
  • DOI: 10.1021/jp912060e

Effect of van der Waals Interactions on the Adsorption of Olympicene Radical on Cu(111): Characteristics of Weak Physisorption versus Strong Chemisorption
journal, February 2013

  • Yildirim, Handan; Kara, Abdelkader
  • The Journal of Physical Chemistry C, Vol. 117, Issue 6
  • DOI: 10.1021/jp311361e

The gold–sulfur interface at the nanoscale
journal, May 2012


UPS, XPS, and NEXAFS Study of Self-Assembly of Standing 1,4-Benzenedimethanethiol SAMs on Gold
journal, April 2011

  • Pasquali, Luca; Terzi, Fabio; Seeber, Renato
  • Langmuir, Vol. 27, Issue 8
  • DOI: 10.1021/la105063u

From ultrasoft pseudopotentials to the projector augmented-wave method
journal, January 1999


On the self assembly of short chain alkanedithiols
journal, January 2008

  • Hamoudi, Hicham; Guo, Zhiang; Prato, Mirko
  • Physical Chemistry Chemical Physics, Vol. 10, Issue 45
  • DOI: 10.1039/b809760g

Gas Phase Formation of Dense Alkanethiol Layers on GaAs(110)
journal, June 2007

  • Rodríguez, Luis M.; Gayone, J. Esteban; Sánchez, Esteban A.
  • Journal of the American Chemical Society, Vol. 129, Issue 25
  • DOI: 10.1021/ja069007s

Adsorption mechanisms, structures, and growth regimes of an archetypal self-assembling system: Decanethiol on Au(111)
journal, May 1998


Self-Assembled Monolayers of Thiolates on Metals as a Form of Nanotechnology
journal, April 2005

  • Love, J. Christopher; Estroff, Lara A.; Kriebel, Jennah K.
  • Chemical Reviews, Vol. 105, Issue 4
  • DOI: 10.1021/cr0300789

Nature of electrical contacts in a metal–molecule–semiconductor system
journal, March 2003

  • Hsu, J. W. P.; Loo, Y. L.; Lang, D. V.
  • Journal of Vacuum Science & Technology B: Microelectronics and Nanometer Structures, Vol. 21, Issue 4, p. 1928-1935
  • DOI: 10.1116/1.1588641

X-ray and Low Energy Electron Induced Damage in Alkanethiolate Monolayers on Au-substrates
journal, January 1997


Electronic Structure of an Organic/Metal Interface: Pentacene/Cu(110)
journal, October 2012

  • Müller, Kathrin; Seitsonen, Ari P.; Brugger, Thomas
  • The Journal of Physical Chemistry C, Vol. 116, Issue 44
  • DOI: 10.1021/jp308058u

X-ray Photoelectron Spectroscopy Sulfur 2p Study of Organic Thiol and Disulfide Binding Interactions with Gold Surfaces
journal, January 1996

  • Castner, David G.; Hinds, Kenneth; Grainger, David W.
  • Langmuir, Vol. 12, Issue 21
  • DOI: 10.1021/la960465w

X-ray Diffraction and Computation Yield the Structure of Alkanethiols on Gold(111)
journal, August 2008


Local Methylthiolate Adsorption Geometry on Au(111) from Photoemission Core-Level Shifts
journal, March 2009


Direct Adsorption and Monolayer Self-Assembly of Acetyl-Protected Dithiols
journal, March 2006

  • Lau, King Hang Aaron; Huang, Chun; Yakovlev, Nikolai
  • Langmuir, Vol. 22, Issue 7
  • DOI: 10.1021/la053248g

Gold adatom as a key structural component in self-assembled monolayers of organosulfur molecules on Au(111)
journal, May 2010


Nanografting versus Solution Self-Assembly of α,ω-Alkanedithiols on Au(111) Investigated by AFM
journal, October 2008

  • Yu, Jing-Jiang; Ngunjiri, Johnpeter N.; Kelley, Algernon T.
  • Langmuir, Vol. 24, Issue 20
  • DOI: 10.1021/la802235c

Adlayers of Alkanedithiols on Au(111): Effect of Disulfide Reducing Agent
journal, January 2013

  • Cometto, F. P.; Ruano, G.; Ascolani, H.
  • Langmuir, Vol. 29, Issue 5
  • DOI: 10.1021/la3036067

Disorder, solvent effects and substitutional self-assembly of alkane dithiols from alkane thiol SAMs
journal, January 2011


Sulfidization of Au(111) from Thioacetic Acid: An Experimental and Theoretical Study
journal, October 2012

  • Fischer, Jeison A.; Zoldan, Vinícius C.; Benitez, Guillermo
  • Langmuir, Vol. 28, Issue 43
  • DOI: 10.1021/la303059u

X-ray Studies of Self-Assembled Monolayers on Coinage Metals. 1. Alignment and Photooxidation in 1,8-Octanedithiol and 1-Octanethiol on Au
journal, September 1998

  • Rieley, Hugh; Kendall, Gary K.; Zemicael, Fessehaye W.
  • Langmuir, Vol. 14, Issue 18
  • DOI: 10.1021/la971183e

Trends in Adsorption Characteristics of Benzene on Transition Metal Surfaces: Role of Surface Chemistry and van der Waals Interactions
journal, September 2013

  • Yildirim, Handan; Greber, Thomas; Kara, Abdelkader
  • The Journal of Physical Chemistry C, Vol. 117, Issue 40
  • DOI: 10.1021/jp404487z

1,4-Benzenedimethanethiol Interaction with Au(110), Ag(111), Cu(100), and Cu(111) Surfaces: Self-Assembly and Dissociation Processes
journal, November 2014

  • Jia, Juanjuan; Giglia, Angelo; Flores, Marcos
  • The Journal of Physical Chemistry C, Vol. 118, Issue 46
  • DOI: 10.1021/jp509184t

Structural and electronic properties of anisotropic ultrathin organic films from dichroic resonant soft x-ray reflectivity
journal, January 2014


"Coulomb Staircase" at Room Temperature in a Self-Assembled Molecular Nanostructure
journal, May 1996


Fabrication of Self-Assembled Monolayers Exhibiting a Thiol-Terminated Surface
journal, September 2004

  • Niklewski, A.; Azzam, W.; Strunskus, T.
  • Langmuir, Vol. 20, Issue 20
  • DOI: 10.1021/la049619v

Bottom-up nanoarchitectonics of two-dimensional freestanding metal doped carbon nanosheet
journal, January 2014


Optimization of Gaussian-type basis sets for local spin density functional calculations. Part I. Boron through neon, optimization technique and validation
journal, February 1992

  • Godbout, Nathalie; Salahub, Dennis R.; Andzelm, Jan
  • Canadian Journal of Chemistry, Vol. 70, Issue 2
  • DOI: 10.1139/v92-079

Lying-Down to Standing-Up Transitions in Self Assembly of Butanedithiol Monolayers on Gold and Substitutional Assembly by Octanethiols
journal, February 2013

  • Jia, Juanjuan; Mukherjee, Subhrangsu; Hamoudi, Hicham
  • The Journal of Physical Chemistry C, Vol. 117, Issue 9
  • DOI: 10.1021/jp3115786

TEMPO: a New Insertion Device Beamline at SOLEIL for Time Resolved Photoelectron Spectroscopy Experiments on Solids and Interfaces
conference, January 2010

  • Polack, F.; Silly, M.; Chauvet, C.
  • SRI 2009, 10TH INTERNATIONAL CONFERENCE ON RADIATION INSTRUMENTATION, AIP Conference Proceedings
  • DOI: 10.1063/1.3463169

Chalcogen Atom Interaction with Palladium and the Complex Molecule–Metal Interface in Thiol Self Assembly
journal, October 2014

  • Jia, Juanjuan; Bendounan, Azzedine; Chaouchi, Karine
  • The Journal of Physical Chemistry C, Vol. 118, Issue 43
  • DOI: 10.1021/jp507051q

Structure of 1,4-Benzenedimethanethiol Self-Assembled Monolayers on Gold Grown by Solution and Vapor Techniques
journal, April 2003

  • Pugmire, David L.; Tarlov, Michael J.; van Zee, Roger D.
  • Langmuir, Vol. 19, Issue 9
  • DOI: 10.1021/la0208530

Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
journal, July 1996


Self-Assembly of 1,4-Benzenedimethanethiol Self-Assembled Monolayers on Gold
journal, May 2010

  • Hamoudi, Hicham; Prato, Mirko; Dablemont, Céline
  • Langmuir, Vol. 26, Issue 10
  • DOI: 10.1021/la904317b

Interaction of l-cysteine with naked gold nanoparticles supported on HOPG: a high resolution XPS investigation
journal, January 2012

  • Caprile, Laura; Cossaro, Albano; Falletta, Ermelinda
  • Nanoscale, Vol. 4, Issue 24
  • DOI: 10.1039/c2nr32741d

Projector augmented-wave method
journal, December 1994


Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
journal, October 1996


A detailed analysis of the photoemission spectra of basic thioaromatic monolayers on noble metal substrates
journal, March 2006

  • Shaporenko, A.; Terfort, A.; Grunze, M.
  • Journal of Electron Spectroscopy and Related Phenomena, Vol. 151, Issue 1
  • DOI: 10.1016/j.elspec.2005.10.008

Going beyond the self-assembled monolayer: metal intercalated dithiol multilayers and their conductance
journal, January 2014

  • Hamoudi, Hicham; Uosaki, Kohei; Ariga, Katsuhiko
  • RSC Adv., Vol. 4, Issue 75
  • DOI: 10.1039/C4RA05476H

Bonding and orientation of 1,4-benzenedimethanethiol on Au(111) prepared from solution and from gas phase
journal, July 2007


Crossbar nanoarchitectonics of the crosslinked self-assembled monolayer
journal, June 2014


High resolution X-ray photoelectron spectroscopy of 3-mercaptopropionic acid self-assembled films
journal, September 2004


X-ray Induced Damage of Self-Assembled Alkanethiols on Gold and Indium Phosphide
journal, August 1999


Spontaneously Formed Sulfur Adlayers on Gold in Electrolyte Solutions: Adsorbed Sulfur or Gold Sulfide?
journal, July 2008

  • Lustemberg, P. G.; Vericat, C.; Benitez, G. A.
  • The Journal of Physical Chemistry C, Vol. 112, Issue 30
  • DOI: 10.1021/jp8029055

Scanning Tunneling Microscopy Observations of α,ω-Bis(mercaptomethylthienyl)alkane Derivatives Self-Assembled on Au(111)
journal, January 1996

  • Nakamura, Tohru; Kondoh, Hiroshi; Matsumoto, Mutsuyoshi
  • Langmuir, Vol. 12, Issue 25
  • DOI: 10.1021/la960722x

Probing Occupied States of the Molecular Layer in Au−Alkanedithiol−GaAs Diodes
journal, March 2005

  • Hsu, Julia W. P.; Lang, David V.; West, Kenneth W.
  • The Journal of Physical Chemistry B, Vol. 109, Issue 12
  • DOI: 10.1021/jp044246s

Structure and properties of 1,4-benzenedimethanethiol films grown from solution on Au(111): An XPS and NEXAFS study
journal, March 2007


Spectroscopic ellipsometry of self assembled monolayers: interface effects. The case of phenyl selenide SAMs on gold
journal, January 2013

  • Canepa, Maurizio; Maidecchi, Giulia; Toccafondi, Chiara
  • Physical Chemistry Chemical Physics, Vol. 15, Issue 27
  • DOI: 10.1039/c3cp51304a

Thiol Terminated 1,4-Benzenedimethanethiol Self-Assembled Monolayers on Au(111) and InP(110) from Vapor Phase
journal, November 2010

  • Alarcón, Leonardo Salazar; Chen, Lin; Esaulov, Vladimir A.
  • The Journal of Physical Chemistry C, Vol. 114, Issue 47
  • DOI: 10.1021/jp1044157

Nanostructuring, Imaging and Molecular Manipulation of Dithiol Monolayers on Au(111) Surfaces by Atomic Force Microscopy
journal, October 2007

  • Liang, Jian; Rosa, Luis G.; Scoles, Giacinto
  • The Journal of Physical Chemistry C, Vol. 111, Issue 46
  • DOI: 10.1021/jp076470y

Self-Assembly of a Two-Dimensional Superlattice of Molecularly Linked Metal Clusters
journal, September 1996


Reactivity of 1,8-octanedithiol monolayers on Au(111): Experimental and theoretical investigation
journal, May 2005