J. Delhalle

D. Alamarguy, S. Géribaldi, J. Delhalle, 2004, Proceedings of the 50th IEEE Holm Conference on Electrical Contacts and the 22nd International Conference on Electrical Contacts Electrical Contacts, 2004..

Mechanically polished copper surfaces modified with n-dodecanethiol and 3-perfluorooctyl-propanethiol

S. Géribaldi, J. Delhalle, Z. Mekhalif, 2002 .

X-ray photoelectron spectroscopy and x-ray emission spectroscopy of poly(ethylene oxide) and poly(vinyl alcohol): experiment and theory

P. Boulanger, J. Delhalle, J. Verbist, 1991 .

The use of water-soluble pyrene derivatives to probe the surface of carbon nanotubes

J. Nagy, S. Devillers, J. Delhalle, 2011 .

First attempts at an elucidation of the interface structure resulting from the interaction between methacrylonitrile and a platinum anode: an experimental and theoretical (ab initio) study

J. Delhalle, M. Guittet, G. Deniau, 1996 .

Efficient calculation of the exchange in the Fourier representation of HF‐LCAO‐CO equations for 1D periodic systems

J. G. Fripiat, J. Delhalle, 2009 .

Electrochemical Co-Deposition of Phosphonate-Modified Carbon Nanotubes and Tantalum on Nitinol

J. Delhalle, Z. Mekhalif, G. Fonder, 2014 .

Dispersion of multi-walled carbon nanotubes in biocompatible dispersants

B. Masereel, S. Rolin, J. Delhalle, 2010 .

3,5,11,13-tetraazacycl[3.3.3]azine: theoretical (ab initio) and experimental (X-ray and ultraviolet photoelectron spectroscopy) studies of the electronic structure

J. G. Fripiat, J. Delhalle, J. Verbist, 1984 .

Comparative study of the monolayers of CH3(CH2)nSiCl3 and CH3(CH2)nPO(OH)2, n = 4 and 13, adsorbed on polycrystalline titanium substrates

J. Delhalle, Z. Mekhalif, G. Philippin, 2003 .

Synthesis of 6‐(1′‐pyrrolyl)‐n‐hexyltrichlorosilane and 6‐(1′‐pyrrolyl)‐n‐hexyltrimethoxysilane: XPS characterization of their monolayers self‐assembled on polycrystalline titanium surfaces

J. Delhalle, Z. Mekhalif, J. Pireaux, 2001 .

Prospective theoretical and experimental study towards electrochemically grafted poly(N-vinyl-2-pyrrolidone) films on metallic surfaces

M. Defranceschi, J. Delhalle, P. Viel, 1992 .

UPS and XPS study of the polymer/metal interface of poly(2-methyl-2-propenenitrile) electropolymerized on an oxidized nickel surface cathode

J. Delhalle, P. Viel, G. Deniau, 1992 .

Polymer-film formation on the surface of a cathodically polarized nickel electrode in the presence of 4-chlorostyrene

J. Delhalle, P. Viel, G. Zalczer, 1990 .

Electronic structure of conducting polymers from heteroaromatic bicyclic compounds

J. Brédas, R. Lazzaroni, J. Delhalle, 1987 .

FSGO band structure calculations of polyethers in Fourier space

J. G. Fripiat, J. Delhalle, I. Flamant, 1998 .

Electronic structure of polyethylene: Theory and ESCA measurements

J. Delhalle, J. Verbist, R. Caudano, 1974 .

Potentialities of the gelius intensity model in quality control of valence XPS measurements

J. G. Fripiat, J. Delhalle, J. Riga, 1984 .

Electrografting of mixed organophosphonic monolayers for SI-ATRP of 2-methacryloyloxyethyl phosphorylcholine

L. Mespouille, Bastien Arrotin, J. Delhalle, 2019, Journal of Coatings Technology and Research.

Comparative Ab initio analysis of valence XPS data for acenes and paraphenyl oligomers: Application of the molecular-orbital intensity model

J. G. Fripiat, J. Delhalle, J. Riga, 1984 .

Theoretical Interpretation of Valence XPS Spectra of Stereo-Regular Organic Polymers

J. Delhalle, J. André, 1984 .

Computation of LCAO Wave Functions for Ground States of Polymers and Solids

J. G. Fripiat, J. Delhalle, J. André, 1971 .

Use of pyrophosphate and boric acid additives in the copper-zinc alloy electrodeposition and chemical dealloying

J. Delhalle, Z. Mekhalif, F. Renner, 2019, Journal of Electroanalytical Chemistry.

X-Ray photoelectron spectroscopy study of polycrystalline zinc modified by n-dodecanethiol and 3-perfluorooctyl-propanethiol

F. Guittard, S. Géribaldi, J. Delhalle, 2002 .

Surface modification of polycrystalline iron surfaces by n-dodecanethiol: an XPS investigation

J. Delhalle, Z. Mekhalif, J. Pireaux, 2001 .

Acrylonitrile versus allyl cyanide: The role of electronic conjugation in high electric field condition

J. Delhalle, C. Reynaud, M. Raynaud, 1991 .

Finite hydrocarbon chains incorporating cumulenic structures: prediction by ab initio calculations of their equilibrium geometry and electric polarizability

J. G. Fripiat, J. Delhalle, J. André, 1987 .

Influence of cross section on the density of states distribution of polyethylene

J. Delhalle, J. André, S. Delhalle, 1975 .

Electronic structure of segmented polyacetylene: Influence of a random distribution of sp3 defects and soliton wavefunction characteristics

J. Brédas, J. Delhalle, J. Toussaint, 1989 .

Exchange effects on the inner valence and core energy bands and density of states of metallic chains

J. Delhalle, J. Calais, 1988 .

A Theoretical Approach to Highly Conducting and Non-linear Optically Active Polymers

J. Brédas, J. Delhalle, J. André, 1988 .

Some aspects of bonding and binding in polymeric chains

J. Brédas, J. Delhalle, J. André, 1981 .

Restricted hartree-fock investigation of the changes induced in the electronic structure of an infinite chain of hydrogen atoms when doping with lithium

J. Brédas, J. Delhalle, J. André, 1981 .

Study of (3-mercaptopropyl)trimethoxysilane reactivity on zinc: Comparison with organothiol and organosilane thin films

J. Delhalle, Z. Mekhalif, F. Sinapi, 2007 .

Electronic Structure and Static Electric Dipole Polarizability of Acetylenic Analogs of Carbocyanines

J. Delhalle, J. André, V. Bodart, 1990 .

Electronic structure and nonlinear optical properties of aromatic polymers and their derivatives

J. Brédas, J. Delhalle, J. André, 1989 .

A posteriori symmetry analysis of polymer electronic band structures

M. Damnjanović, J. Delhalle, I. Božović, 1981 .

A novel and sensitive hexadecyltrimethylammoniumbromide functionalized Fe decorated MWCNTs modified carbon paste electrode for the selective determination of Quercetin.

Ronald J. Mascarenhas, J. Delhalle, Z. Mekhalif, 2017, Materials science & engineering. C, Materials for biological applications.

Ab initio calculations of all-trans octatetraene and eight isoelectronic conjugated chains: Semiempirical heats of formation and stabilization energies

J. Delhalle, J. André, E. Younang, 1992 .

The FAKE method of molecular orbital calculation

F. Harris, J. Delhalle, A. Trautwein, 2009 .

Fake molecular-orbital calculations

F. Harris, J. Delhalle, A. Trautwein, 1980 .

Carbon nanotube catalytic deposition synthesis

J. Nagy, O. Guellati, M. Guerioune, 2007, 2007 ICTON Mediterranean Winter Conference.

Insights into the molecular structure and chemical bonding of regular oligomers and polymers from their XPS valence spectra

M. Deleuze, J. Delhalle, 1992 .

Second-order Green's function calculations of the ionization potential of a (H2)7 chain embedded in a homogeneous electric field

B. T. Pickup, M. Deleuze, J. Delhalle, 1992 .

Ab initio study of the influence of aggregation on the infrared spectrum of acetonitrile

D. Mathieu, M. Defranceschi, J. Delhalle, 1993 .

Exact and approximate Hartree–Fock calculations for extended metallic systems

J. Delhalle, J. Calais, 1992 .

Optimization of cuprous oxide nanocrystals deposition on multiwalled carbon nanotubes

J. Delhalle, Z. Mekhalif, A. Fonseca, 2010 .

Copper–zinc alloy electrodeposition mediated by triethanolamine as a complexing additive and chemical dealloying

J. Delhalle, Z. Mekhalif, F. Renner, 2019, Electrochimica Acta.

Surface-initiated ATRP of 2-(methacryloyloxy)ethyl 2-(trimethylammonio)ethyl phosphate on Phynox

S. Devillers, J. Delhalle, Z. Mekhalif, 2011 .

Preparation and electrical characterization of a silicone elastomer composite charged with multi-wall carbon nanotubes functionalized with 7-octenyltrichlorosilane

J. Nagy, J. Delhalle, Z. Mekhalif, 2007 .

Many-body Green's function study of the valence band formation of polyoxymethylene

D. H. Mosley, M. Deleuze, J. Delhalle, 1995 .

Second-order Green's function study of valence band formation of linear alkanes

B. T. Pickup, J. Delhalle, Michaël Delueze, 1992 .

Application of the Green's function theory to the calculation of ionization potentials of model oligomeric systems

M. Deleuze, J. Delhalle, J. André, 1992 .

Electrochemical elaboration of adherent poly (3,4-ethylene-dioxythiophene) films and hybride nanowires on nickel

J. Delhalle, Z. Mekhalif, F. Lallemand, 2008 .

Improving the one-electron states of ab initio LCAO-GTO calculations in momentum space. Application to be and B+ atoms

J. G. Fripiat, M. Defranceschi, J. Delhalle, 1992 .

Gas phase UPS study of naphtho[1,8-cd: 4,5-c'd'] bis[1,2,6] thiadiazine

J. G. Fripiat, R. Haddon, J. Delhalle, 1984 .

Electronic structure of naphtho[1,8-cd:4,5-c'd']bis[1,2,6]thia- and -selenadiazines. Ab initio calculations and photoelectron spectra

J. G. Fripiat, R. Haddon, J. Delhalle, 1982 .

Development of Al-5%Zn-0.5%Sn-2.6%Mg Alloy as Sacrificial Anode for Cathodic Protection of Steel in 3 wt.% NaCl Solution

J. Delhalle, Z. Mekhalif, D. Boughrara, 2021 .

Theoretical study of the dependence of the valence electronic levels on the tacticity and conformation of acrylonitrile model oligomers

J. Delhalle, G. Lécayon, C. Boiziau, 1990 .

ELECTRONIC STRUCTURE OF NAPHTHO(1,8-CD:4,5-C′D′)BIS(1,2,6)THIA- AND -SELENADIAZINES. AB INITIO CALCULATIONS AND PHOTOELECTRON SPECTRA

J. G. Fripiat, R. Haddon, J. Delhalle, 1982 .

Attempts to calculate the electron affinity of acrylonitrile

D. H. Mosley, B. T. Pickup, J. Delhalle, 1992 .

Study of the formation process and the characteristics of tantalum layers electrodeposited on Nitinol plates in the 1-butyl-1-methylpyrrolidinium bis(trifluoromethylsulfonyl)imide ionic liquid

J. Delhalle, Z. Mekhalif, A. Maho, 2013 .

Induction heating vs conventional heating for the hydrothermal treatment of nitinol and its subsequent 2-(methacryloyloxy)ethyl 2-(trimethylammonio)ethyl phosphate coating by surface-initiated atom transfer radical polymerization.

S. Devillers, J. Delhalle, Z. Mekhalif, 2011, ACS applied materials & interfaces.

Multipole expansion in tight-binding Hartree-Fock calculations for infinite model polymers

L. Piela, J. Brédas, J. Delhalle, 1980 .

Electrochemical synthesis and characterization of N-substituted polypyrrole derivatives on nickel

J. Delhalle, Z. Mekhalif, F. Lallemand, 2007 .

Modern Quantum Mechanical Techniques and Computations on the Electronic Structure of Polymers (Invited Paper)

Benoît Champagne, Jean-Marie André, Joseph Delhalle, 1994, HPCN.

Quantum chemistry and molecular engineering of oligomeric and polymeric materials for optoelectronics

J. Delhalle, J. André, 1991 .

Ab initio calculations of the static electric polarizability of infinite polymer chains

J. Delhalle, C. Barbier, J. André, 1989 .

Potential use of the unit cell arbitrary concept to evaluate long‐range interactions in quantum mechanical studies of model polymers

L. Piela, J. Delhalle, J. André, 2009 .

On the use of laplace transform to evaluate one‐dimensional lattice summations in quantum calculations of model polymers

J. G. Fripiat, L. Piela, J. Delhalle, 2009 .

Long‐range coulombic interactions in the theory of polymers: A statement of the problem and a method for calculation by the fourier transformation technique

J. G. Fripiat, J. Brédas, J. Delhalle, 2009 .

Evaluation of some trigonometric series occurring in infinite chain polymer calculations

F. Harris, J. Delhalle, S. Delhalle, 1978 .

Application of the FAKE molecular-orbital method to diatomic molecules XY (X, Y = H, F, Cl, Br, I)

F. Harris, J. Delhalle, A. Trautwein, 1985 .

Numerical orbital Fourier space approach to polymer band‐structure calculations

J. D. Talman, J. G. Fripiat, J. Delhalle, 2009 .

Virtues and potentialities of the Fourier transform method for electronic structure calculations of 1‐D periodic systems at the Hartree–Fock level and beyond

J. G. Fripiat, F. Harris, J. Delhalle, 2002 .

Evaluation of computational aspects of a modified CS‐LCAO‐SCF‐CO strategy for electronic structure calculations of extended model chains

J. G. Fripiat, F. Harris, J. Delhalle, 1984 .

Prediction of longitudinal electric polarizabilities of conjugated chain molecules by scaling of ab initio calculations

J. Zyss, J. Delhalle, J. André, 1985 .

Theoretical-study of the Electronic-structure of Ketene, Ketenimine, Keteniminium Ion and Related Cumulenes - Evaluation of a 1,2-dipolar Model

J. G. Fripiat, J. Delhalle, E. Sonveaux, 2010 .

Improving the One‐Electron States of ab initio GTO Calculations in Momentum Space. Tests on two‐Electron Systems: H−, He and Li−+

J. G. Fripiat, M. Defranceschi, J. Delhalle, 2010 .

Electronic structure of Li− and F− calculated directly in momentum space

M. Defranceschi, J. Delhalle, L. D. Windt, 1993 .

The electronic structure of β-propiolactone (2-oxetanone) and of some 3- and 4-substituted 2-oxetanones

J. G. Fripiat, J. Delhalle, J. André, 1984 .

Conformational origin of peak structure arising in the XPS Spectrum of an isotactic polypropylene

J. Delhalle, J. André, C. Demanet, 1979 .

A Comparative Study of the Electro-Assisted Grafting of Mono- and Bi-Phosphonic Acids on Nitinol

L. Mespouille, P. Dubois, Bastien Arrotin, 2019, Surfaces.

Electroassisted Functionalization of Nitinol Surface, a Powerful Strategy for Polymer Coating through Controlled Radical Surface Initiation.

L. Mespouille, P. Dubois, Bastien Arrotin, 2017, Langmuir : the ACS journal of surfaces and colloids.

Electroassisted auto-assembly of alkylphosphonic acids monolayers on nitinol

S. Devillers, J. Delhalle, Z. Mekhalif, 2016 .

Comparative study of acrylonitrile, 2-butenenitrile, 3-butenenitrile, and 2-methyl-2-propenenitrile electropolymerization on a nickel cathode

J. Delhalle, P. Viel, G. Deniau, 1992 .

Theoretical monomer/cluster model of a polymer/metal interface: poly(methacrylonitrile) on a nickel surface

M. Defranceschi, J. Delhalle, G. Deniau, 1994 .

Preliminary theoretical study of acrylonitrile and its methyl derivatives as monomers for cathodic electropolymerization

M. Defranceschi, J. Delhalle, G. Lécayon, 1991 .

High electric field effects on the acrylonitrile molecule: An ab initio study

J. Delhalle, C. Reynaud, M. Raynaud, 1990 .

An ab initio study of the electric field influence on the electron distribution of HCN, CH3CN, CH2CHCN, and CH2C(CN)2

J. Delhalle, C. Reynaud, M. Raynaud, 1988 .

Electrochemistry as a Tool to Monitor Lewis Acid-Base Reactions between Methacrylonitrile and Metallic Surfaces: A Theoretical and Experimental Proposal

J. Delhalle, P. Viel, G. Deniau, 1996 .

Comparative study of Cu–Zn coatings electrodeposited from sulphate and chloride baths

A. Kadri, J. Delhalle, Z. Mekhalif, 2019, Heliyon.

Multifunctional hybrid coating on titanium towards hydroxyapatite growth : electrodeposition of tantalum and its molecular functionalization with organophosphonic acids films

J. Delhalle, Z. Mekhalif, C. Arnould, 2008 .

Electrochemical evaluation of the corrosion protection of bi-dimensional organic films self-assembled onto brass

J. Delhalle, Z. Mekhalif, S. Deroubaix, 2004 .

Influence of applied potential on tin content in electrodeposition of Zn–Sn alloy coatings and its effect on corrosion protection

J. Delhalle, Z. Mekhalif, A. Madani, 2022, Inorganic and Nano-Metal Chemistry.

Underpotential Deposition of Nickel on {111}-Textured Gold Electrodes in Dimethyl Sulfoxide

A. Vaskevich, I. Rubinstein, J. Delhalle, 2005 .

Bilayers coating on titanium surface: the impact on the hydroxyapatite initiation.

J. Delhalle, Z. Mekhalif, J. Denayer, 2010, Journal of colloid and interface science.

Electrodeposition from Ionic Liquid of 2D Ordered Ta2O5 on Titanium Substrate Through a Polystyrene Template

J. Delhalle, Z. Mekhalif, C. Arnould, 2009 .

Titanium modified with layer-by-layer sol-gel tantalum oxide and an organodiphosphonic acid: a coating for hydroxyapatite growth.

C. Lamarque, C. Volcke, J. Delhalle, 2009, Journal of colloid and interface science.

Theoretical Design of Polymeric Materials for Nonlinear Optics

J. Brédas, J. Delhalle, J. André, 1987 .

Monolayers and mixed-layers on copper towards corrosion protection

J. Delhalle, Z. Mekhalif, L. Hevesi, 2008 .

Comparative study of copper surface treatment with self-assembled monolayers of aliphatic thiol, dithiol and dithiocarboxylic acid

J. Delhalle, Z. Mekhalif, J. Denayer, 2009 .

Surface modifications of nickel substrates with self-assembled monolayers of alkanethiols for electrical contact applications

S. Noël, F. Houzé, J. Delhalle, 1998 .

Self-assembled monolayers of alcanethiols on nickel surfaces for low level electrical contact applications

R. Caudano, L. Boyer, S. Noel, 1997, Electrical Contacts - 1997 Proceedings of the Forty-Third IEEE Holm Conference on Electrical Contacts.

Surface modification of copper with 2-dodecylpropane-1,3-dithiol: The key effect of the solvent

J. Delhalle, Z. Mekhalif, J. Denayer, 2009 .

XPS and electrochemical evaluation of two-dimensional organic films obtained by chemical modification of self-assembled monolayers of (3-mercaptopropyl)trimethoxysilane on copper surfaces

J. Delhalle, Z. Mekhalif, F. Sinapi, 2002 .

XPS and electrochemical characterisation of polycrystalline copper modified with 12-(N-pyrrolyl)-n-dodecanethiol

J. Delhalle, Z. Mekhalif, F. Laffineur, 2001 .

Textural and structural effects of heat treatment and γ-irradiation on Cs-exchanged NaX zeolite, bentonite and their mixtures

J. Delhalle, Z. Mekhalif, Y. Boucheffa, 2012 .

Undec-10-ene-1-thiol multifunctional molecular layer as a junction between metallic zinc and polymer coatings on steel

J. Delhalle, Z. Mekhalif, F. Berger, 2009 .

Polymer Primary Structures Studied by ESCA and EHCO Methods

J. Delhalle, J. Riga, J. Verbist, 1977 .

Tantalum oxide/carbon nanotubes composite coatings on titanium, and their functionalization with organophosphonic molecular films: a high quality scaffold for hydroxyapatite growth.

J. Delhalle, Z. Mekhalif, S. Detriche, 2012, Journal of colloid and interface science.

Effects of the dispersion methods in Pluronic F108 on the size and the surface composition of MWCNTs and their implications in toxicology assessment

B. Masereel, J. Delhalle, Z. Mekhalif, 2011 .

Hybrid coating on steel: ZnNi electrodeposition and surface modification with organothiols and diazonium salts

J. Delhalle, Z. Mekhalif, F. Berger, 2008 .

Chitosan and Alginate Layer-by-Layer Assembly on Phynox (Co-Cr Alloy) Surface Modified by Alkylcarboxylicammoniumphosphonate Derivatives

S. Devillers, J. Delhalle, Z. Mekhalif, 2013 .

Self-assembly of (3-mercaptopropyl)trimethoxysilane on polycrystalline zinc substrates towards corrosion protection

J. Delhalle, Z. Mekhalif, F. Sinapi, 2003 .

Surface coating of a Cu-Ni alloy with a self-assembled monolayer of n-dodecanethiol

J. Delhalle, Z. Mekhalif, F. Laffineur, 2002 .

Electropolymerization of pyrrole on silanized polycrystalline titanium substrates

J. Delhalle, Z. Mekhalif, L. Hevesi, 2008 .

Conformational Effects on the Valence Electronic Structure of Polyethylene

J. Delhalle, J. André, C. Demanet, 2010 .

Electronic structure of linear fluoropolymers: Theory and ESCA measurements revisited

Jean-Jacques Pireaux, Joseph Delhalle, Joseph Riga, 1977 .

Electronic structure of fluoropolymers : Theory and esca measurements

J. Delhalle, J. Riga, J. Verbist, 1974 .

WAVE-MECHANICAL STUDIES OF LINEAR POLYMERS. CORRELATIONS BETWEEN CHARGE DISTRIBUTIONS AND ESCA CHEMICAL SHIFTS IN POLYFLUOROETHYLENES

J. Delhalle, J. André, 1972 .

Chemical functionalization by a fluorinated trichlorosilane of multi-walled carbon nanotubes

J. Nagy, J. Delhalle, Z. Mekhalif, 2004 .

Electrochemical Investigation of Nitinol/Tantalum Hybrid Surfaces Modified by Alkylphosphonic Self-Assembled Monolayers

C. Combellas, F. Kanoufi, J. Delhalle, 2014 .

Electrochemical elaboration and investigation of Nitinol surfaces covered with tantalum, carbon nanotubes and phosphonic acid self-assembled monolayers

J. Delhalle, Z. Mekhalif, A. Maho, 2014 .

Induction heating for surface triggering styrene polymerization on titanium modified with ATRP initiator.

S. Devillers, J. Delhalle, Z. Mekhalif, 2011, Journal of colloid and interface science.

Fabrication of 2D ordered Ta2O5 films on a titanium substrate by electrodeposition of Ta from ionic liquid through a polystyrene template

J. Delhalle, Z. Mekhalif, C. Arnould, 2009 .

Decoration of tricarboxylic and monocarboxylic aryl diazonium functionalized multi-wall carbon nanotubes with iron nanoparticles

J. Delhalle, Z. Mekhalif, A. Bhakta, 2017, Journal of Materials Science.

Study of the chemical transformations induced at the surface of bulk iron by protons and α beams

J. Delhalle, P. Viel, G. Deniau, 2001 .

A study of the basis set dependence of the geometry and proton affinity for a series of vinyl ethers and vinyl sulfides

J. Delhalle, L. Hevesi, K. Ösapay, 2009 .

Quantum Chemistry Aided Design of Organic Polymers: An Introduction to the Quantum Chemistry of Polymers and Its Applications

Jean-Luc Brédas, Joseph Delhalle, J. Brédas, 1991 .

Equilibrium Geometry and Proton Affinity of Vinyl Ethers and Sulphides by Ab Initio Calculations

J. Delhalle, L. Hevesi, K. Ösapay, 2010 .

Probing the Molecular Primary and Secondary Structures of Saturated Hydrocarbons by X-ray Photoionization Spectroscopy

B. T. Pickup, M. Deleuze, J. Delhalle, 1994 .

Experimental and theoretical studies of the gas-phase protonation of vinyl ethers, vinyl sulfides, and vinyl selenides

R. Houriet, J. Delhalle, L. Hevesi, 1989 .

Pro-inflammatory effects of different MWCNTs dispersions in p16INK4A-deficient telomerase-expressing human keratinocytes but not in human SV-40 immortalized sebocytes

C. Zouboulis, J. Delhalle, O. Toussaint, 2012, Nanotoxicology.

NUMERICAL STUDY OF THE EXCHANGE EFFECTS IN THE VALENCE AND CORE ENERGY BANDS OF THE METALLIC LITHIUM CHAIN

J. G. Fripiat, J. Delhalle, I. Flamant, 1997 .

Polymer-layered silicate–carbon nanotube nanocomposites: unique nanofiller synergistic effect

Robert Sporken, Joseph Delhalle, Janos B. Nagy, 2004 .

An XPS valence band study of alkane chains secondary structure

M. Deleuze, J. Delhalle, J. Riga, 1994 .

An XPS study of hexagonal polyoxymethylene with various bulk morphologies: surface modification under X-ray exposure

J. Delhalle, J. Riga, J. Verbist, 1988 .

Accurate density functional calculation of core electron binding energies

D. Chong, J. Delhalle, G. Lécayon, 1997 .

Fourier representation method for electronic structures of linear polymers

F. Harris, J. Delhalle, 1978, Theoretica chimica acta.

XPS fast depth profile of the native oxide layers on AISI 304, 316 and 430 commercial stainless steels and their evolution with time

J. Delhalle, Z. Mekhalif, P. Louette, 2020 .

Computational Aspects of Polymer Band Structure Calculations by the Fourier Space Restricted Hartree-Fock Method

J. G. Fripiat, F. Harris, J. Delhalle, 2000 .

Size-Consistency and Size-Intensivity Aspects of Many-Body Green's Function Calculations on Polymers : Characterization of the Convergence of Direct Lattice Self-energy Summations

B. T. Pickup, M. Deleuze, J. Delhalle, 1995 .

Occupation function in extended systems

J. Delhalle, J. Calais, 1988 .

On the behaviour of exchange in restricted hartree-fock-roothaan calculations for periodic polymers

J. G. Fripiat, L. Piela, J. Delhalle, 1981 .

Relations between esca and valence energy band structures of stereoregular polymers

J. Delhalle, 1980 .

Quantum Chemistry Computations in Momentum Space

J. G. Fripiat, M. Defranceschi, J. Delhalle, 1996 .

Electronic structure of H2 and HeH+ computed directly in momentum space

M. Defranceschi, J. Delhalle, L. D. Windt, 1993 .

Molecular Hartree-Fock equations for iteration-variation calculations in momentum space

M. Defranceschi, J. Delhalle, P. Fischer, 1992 .

A Momentum Space Approach to Improve ab initio Hartree-Fock Results Based on the LCAO-GTF Approximation

J. G. Fripiat, M. Defranceschi, J. Delhalle, 1989 .

Plane wave and orthogonalized plane wave many-body Green's function calculations of photoionization intensities

B. T. Pickup, M. Deleuze, J. Delhalle, 1994 .

Translation symmetry for many-electron functions

B. T. Pickup, M. Deleuze, J. Delhalle, 1995 .

Trends in Calculations of Polarizabilities and Hyperpolarizabilities of Long Molecules

J. Delhalle, C. Barbier, J. André, 1987 .

An Ab Initio computational scheme for polymeric chains with fully converged coulomb and exchange lattice sums

J. G. Fripiat, J. Delhalle, J. André, 1991 .

Preparation and Characterization of Carbon Nanotube/Polyacrylonitrile Composites

J. Nagy, J. Delhalle, A. Fonseca, 2002 .

INSIGHT INTO POLYACRYLONITRILE MOLECULAR STRUCTURE FROM CALCULATED VIBRATIONAL FREQUENCIES AND INFRARED INTENSITIES OF MODEL OLIGOMERS

D. Mathieu, M. Defranceschi, J. Delhalle, 1994 .

Numerical determination of the electronic structure of atoms, diatomic and polyatomic molecules

Joseph Delhalle, Mireille Defranceschi, M. Defranceschi, 1989 .

Ewald-type formulas for Gaussian-basis Bloch states in one-dimensionally periodic systems.

J. G. Fripiat, F. Harris, J. Delhalle, 2010, The Journal of chemical physics.

Electrochemical Impedance Spectroscopy as a Powerful Assessment Tool for the Electropolishing Quality of AISI 304 Stainless Steel

J. Delhalle, Z. Mekhalif, S. Detriche, 2020, Materials Research and Applications.

Electrochemical deposition of polypyrrole films on organosilane-modified ITO substrates

J. Delhalle, Z. Mekhalif, L. Hevesi, 2003 .

Synthesis and characterization of maghemite nanocrystals decorated multi-wall carbon nanotubes for methylene blue dye removal

Sunita Kumari, J. Delhalle, Z. Mekhalif, 2018, Journal of Materials Science.

B.I.P. an interactive graphic system for indexing energy bands of model polymers

Jean-Marie André, Joseph Delhalle, D. Thelen, 1979, Comput. Chem..

An Ab Initio Study of the Equilibrium Geometry and Electric Polarizability of Polyethylene, Polysilane, Polyacetylene and Polysilylene Model Compounds

J. G. Fripiat, B. Champagne, J. Delhalle, 2010 .

Anchoring of alkylphosphonic derivatives molecules on copper oxide surfaces

C. Volcke, S. Devillers, J. Delhalle, 2011 .

Electropolymerization of bithiophene on aluminum surfaces modified by CH3(CH2)9-SH and ø-(CH2)m-SH, m = 0 to 3

F. Garnier, J. Delhalle, Z. Mekhalif, 1999 .

Fourier representation method for electronic structures of linear polymers

F. Harris, J. Delhalle, 1972 .

Multi-wall Carbon Nanotubes Decorated with Barium Oxide Nanoparticles

J. Delhalle, Z. Mekhalif, A. Bhakta, 2018 .

A nonempirical molecular orbital study of the siting and pairing of aluminum in ferrierite

Joseph Delhalle, Janos B. Nagy, Eric G. Derouane, 1985 .

Surface modifications of carbon nanotube/polyacrylonitrile composite films by proton beams

J. Nagy, J. Delhalle, Z. Mekhalif, 2003 .

RECENT ADVANCES IN THE PRACTICAL AND ACCURATE CALCULATION OF CORE AND VALENCE XPS SPECTRA OF POLYMERS : FROM INTERPRETATION TO SIMULATION?

D. Chong, J. Delhalle, A. Moël, 1997 .

Cytotoxicity of multi-walled carbon nanotubes in three skin cellular models: Effects of sonication, dispersive agents and corneous layer of reconstructed epidermis

Jorge Mejia, Olivier Toussaint, Joseph Delhalle, 2010, Nanotoxicology.

Electronic Structure and Nonlinear Optical Properties of Polythiophene, Polythieno[3,4-C]thiophene and Polyisothianaphthene Oligomers and Their Vinylene Derivatives

J. Brédas, J. Delhalle, J. André, 1989 .

Electronic And Nonlinear Optical Properties Of Polyarylene Vinylenes And Related Conjugated Systems

J. L. Bredas, M. Dory, B. Themans, 1988, Optics & Photonics.

Large scale synthesis of carbon nanotubes and their composite materials

J. Nagy, L. Biró, I. Kiricsi, 2002 .

Computation of the electronic density of states distributions of stereoregular polymers

J. Delhalle, S. Delhalle, 1977 .

The linear combination of localized orbitals methods (LCLO) for polymers

D. Peeters, J. Delhalle, J. André, 1977 .

Adhesion properties and surface analyses of monolayers of n‐dodecanethiol self‐assembled on galvanic gold†

S. Noël, F. Houzé, J. Delhalle, 1998 .

Preliminary NEXAFS study of polyacrylonitrile samples differing by their isotacticity percentages

M. Defranceschi, G. Tourillon, J. Delhalle, 1993 .

Theoretical study of the X‐ray photoionization spectra of polycycloalkanes

M. Deleuze, J. Delhalle, 1996 .

Diagonal Two-Particle-Hole Tamm-Dankoff Approximation Green's Function Simulation of the Valence X-ray Photoelectron Spectra of Cycloalkanes: Theoretical Search for Signatures of the Molecular Structure

B. T. Pickup, M. Deleuze, J. Delhalle, 1994 .

Dependence of the electronic structure on the chain geometry in stereoregular polypropylene: An exploratory theoretical study

D. H. Mosley, M. Deleuze, J. Delhalle, 1994 .

Diagonal 2ph-TDA Green's function simulation of the valence X-ray photoelectron spectra of n-alkane compounds: a theoretical search for conformational signatures

B. T. Pickup, M. Deleuze, J. Delhalle, 1993 .

Theoretical study of spectral differences in the XPS valence bands of polyethylene lamellae and films

B. T. Pickup, M. Deleuze, J. Delhalle, 1993 .

Theoretical simulations of the valence XPS spectra of three conformations of polyoxymethylene

P. Boulanger, R. Lazzaroni, J. Delhalle, 1986 .

X-ray photoelectron spectroscopic and theoretical study of the conformational dependence of the valence electronic levels in hexagonal and orthorhombic poly(oxymethylenes)

P. Boulanger, J. Delhalle, J. Riga, 1989 .

Preliminary theoretical search for possible conformational signatures in the valence X-ray photoelectron spectra of ordered polyethylene surfaces

J. Delhalle, J. Riga, S. Delhalle, 1987 .

Numerical integration of exchange energy in the two-dimensional Brillouin zone

J. G. Fripiat, F. Harris, J. Delhalle, 2006 .

Fourier representation methods for Møller-Plesset perturbation theory in one-dimensionally periodic systems

J. G. Fripiat, F. Harris, J. Delhalle, 2006 .

Structure and stability of metallic hydrogen

F. Harris, J. Delhalle, 1977 .

Dependence of RHF properties of hydrogen and helium chains on the exchange lattice summations

J. G. Fripiat, J. Delhalle, J. André, 1990 .

Potentials of an alternative scheme for ab initio polymer band structure calculations. Illustration on the chain of hydrogen atoms

J. G. Fripiat, J. Delhalle, J. André, 1989 .

RHF energy band shapes for metallic chains: Dependence on the summation of exchange contributions. An illustration on the linear chain of hydrogen atoms

J. G. Fripiat, J. Delhalle, J. André, 1988 .

LCAO Ab Initio Band Structure Calculations for Polymers

J. G. Fripiat, J. Delhalle, D. P. Vercauteren, 1990 .

Convergence of LCAO density matrices in Hartree—Fock calculations on extended model chains

J. Delhalle, 1984 .

Analysis of the convergence of lattice sums arising in the configuration space Hartree-Fock-Roothaan method for model chains

J. Delhalle, 1984 .

An efficient procedure to evaluate long-range coulombic interactions within the framework of the LCAO–CO method for infinite polymers

L. Piela, J. Delhalle, 1978 .

On the need of precision in the calculation of the LCAO density matrix of polymers

J. Delhalle, 1974 .

Fourier representation method for accurate evaluation of the Coulomb and exchange lattice sums in extended chains

J. G. Fripiat, J. Cizek, J. Delhalle, 1994 .

Pathological aspects of restricted Hartree–Fock band calculations for metallic chains

J. Delhalle, J. Calais, 1987 .

Advantages of the Fourier space RHF band structure approach: Application to polyoxymethylene using a distributed basis set of s-type Gaussian functions

J. G. Fripiat, J. Delhalle, I. Flamant, 1998 .

Fourier Space for Accurate Ab Initio RHF Band Structure Calculations on Chainlike Systems

J. G. Fripiat, J. Delhalle, I. Flamant, 1996 .

RHF Ab initio electronic and molecular structures of a ((SINGLEBOND)Be2(SINGLEBOND))∞ chain

J. G. Fripiat, D. H. Mosley, J. Delhalle, 1996 .

On the restricted Hartree-Fock description of oligomer chains with expected metallic character

J. G. Fripiat, L. Piela, J. Delhalle, 1988 .

Hartree-Fock Pathology and Large Molecules

J. Delhalle, J. Calais, 1987 .

Multipole and overlap integrals over reduced Bessel functions in molecular quantum mechanics

J. Delhalle, D. Antolovic, 1980 .

A nonempirical model potential technique for calculations of band structures of polymers

P. Durand, J. Delhalle, J. André, 2009 .

Long-range interactions in periodic helices. A method for accurate calculation at the hartree-fock level

L. Piela, J. Brédas, J. Delhalle, 2009 .

AMO in linear chains of hydrogen atoms revisited

L. Piela, J. Brédas, J. Delhalle, 2009 .

Towards Specific AB Initio Programs for Polymer Calculations

J. G. Fripiat, J. Brédas, J. Delhalle, 1984 .

On the calculation of long-range coulombic contributions to the direct space LCAO CO matrix elements of model polymers

J. Brédas, J. Delhalle, J. André, 1978 .

Quantum Theory of Polymers

J. Delhalle, J. Ladik, J. André, 1978 .

Influence of ethanol in the presence of H2 on the catalytic growth of vertically aligned carbon nanotubes

C. Pham‐Huu, O. Guellati, M. Guerioune, 2012 .

Multiwalled carbon nanotubes functionalized with 7-octenyltrichlorosilane and n-octyltrichlorosilane: dispersion in Sylgard®184 silicone and Young’s modulus

Luc Carpentier, Joseph Delhalle, Antonio Fonseca, 2009 .

Note on the dispersion in perfluoropolyether lubricants of multi-walled carbon nanotubes functionalized with (tridecafluoro-1,1 ,2,2-tetrahydrooctyl)trichlorosilane.

J. Nagy, J. Delhalle, Z. Mekhalif, 2007, Journal of nanoscience and nanotechnology.

Formation of an adherent polyacrylonitrile/carbon nanotubes composite film onto a polyacrylonitrile brush electrografted on copper.

J. Nagy, J. Delhalle, Z. Mekhalif, 2007, Journal of nanoscience and nanotechnology.

Carbon nanotubes and nanocomposites: electrical, mechanical and flame retardant aspects

J. Coleman, J. Nagy, J. Delhalle, 2006 .

29Si nuclear magnetic resonance of poly(methylphenyl)silane

J. Delhalle, J. Devaux, G. Baudoux, 1996 .

X‐ray photoelectron spectroscopy of an ethylene–tetrafluoroethylene copolymer

J. Delhalle, J. Riga, J. Verbist, 1979 .

X-Ray photoelectron spectroscopy characterization of amorphous and crystalline poly(tetrahydrofuran): experimental and theoretical study

P. Boulanger, J. Delhalle, J. Verbist, 1994 .

Surface state of carbon nanotubes and Hansen solubility parameters.

J. Nagy, J. Delhalle, Z. Mekhalif, 2009, Journal of nanoscience and nanotechnology.

Molecular functionalization of tantalum oxide surface towards development of apatite growth

C. Volcke, J. Delhalle, Z. Mekhalif, 2009 .

Calculations of molecular polarizabilities from electric-field-variant atomic orbitals: An analysis of the problem and its application to the hydrogen molecule and to the alkane series

J. G. Fripiat, L. Piela, J. Delhalle, 1988 .

An FSGO-CO study of the long-range effects on calculated conformational stability and on one-electron levels of polyethylene

J. Brédas, J. Delhalle, J. André, 1980 .

Some aspects of the correlation problem using FSGO orbitals

J. Delhalle, J. André, C. Lamotte, 2010 .

Ab initio Hartree—Fock calculations of model polyacetylene chains using a Christoffersen basis set☆

J. Brédas, J. Delhalle, J. André, 1982 .

Density of electronic states in periodic and disordered chains of segmented polyacetylene

J. Brédas, J. Delhalle, J. André, 1989 .

Density of electronic states of regular and disordered model chains of acetylene-carbon monoxide copolymers

J. Delhalle, J. Ladik, M. Seel, 1987 .

New semifluorinated dithiols self-assembled monolayers on a copper platform.

S. Devillers, J. Delhalle, Z. Mekhalif, 2008, Langmuir : the ACS journal of surfaces and colloids.

Theoretical Design of Organic Molecules and Polymers for Optoelectronics

J. G. Fripiat, J. Delhalle, J. André, 1989 .

Electrodeposition of silicon films from organic solvents on nanoporous copper substrates

J. Delhalle, Z. Mekhalif, F. Renner, 2023, Journal of Applied Electrochemistry.

Fabrication of tantalum oxide/carbon nanotubes thin film composite on titanium substrate.

J. Delhalle, Z. Mekhalif, C Arnould, 2010, Journal of colloid and interface science.

Are stirring and sonication pre-dispersion methods equivalent for in vitro toxicology evaluation of SiC and TiC?

Olivier Toussaint, Joseph Delhalle, Jean-Pascal Piret, 2012, Journal of Nanoparticle Research.

Ab initio CPHF calculations of the static polarizability and second hyperpolarizability of small molecules: Comparisons between standard and moderately large basis sets augmented with diffuse functions

J. G. Fripiat, M. Dupuis, J. Delhalle, 1992 .

Electronic structure of hydrogen-bonded imidazole chains. Influence of the proton position

H. Chojnacki, J. Brédas, J. Delhalle, 1984 .

Electropolymerisation of poly(3,4-ethylene-dioxythiophene) on nickel substrates

J. Delhalle, Z. Mekhalif, F. Plumier, 2003 .

Self-assembled monolayers of alcanethiols on nickel surfaces for low level electrical contact applications

F. Houzé, J. Delhalle, Z. Mekhalif, 1997 .

PROBING THE SURFACE MOLECULAR STRUCTURE IN THE UPS SPECTRA OF OCTADECANETHIOL AND 1-CYCLOHEXYL-12-DODECANETHIOL SELF-ASSEMBLED ON GOLD

Anne-Sophie Duwez, B. Han, J. Delhalle, 1996 .

Surface molecular structure of self-assembled alkanethiols evidenced by UPS, Synchrotron Radiation and HREELS

Anne-Sophie Duwez, J. Delhalle, J. Riga, 1995 .

On the need for computing derivatives of energy bands in band structure caclulations

J. Delhalle, J. André, G. Leroy, 1972 .

Note on the variation step in the iteration–variation approach: Illustration on the hydrogen atom

J. Cizek, J. Delhalle, 1995 .

LCAO Methods for Band Structure Calculations of Polymers

J. Delhalle, J. André, 1978 .

Ewald-type formulas for Gaussian-basis Bloch states in one-dimensionally periodic systems.

J. G. Fripiat, F. Harris, J. Delhalle, 2010, The Journal of chemical physics.

Efficient electronic structure calculations for systems of one-dimensional periodicity with the restricted Hartree–Fock–linear combination of atomic orbitals method implemented in Fourier space

J. G. Fripiat, F. Harris, J. Delhalle, 2000 .

An alternative computational strategy for direct space hartree–fock calculations on extended model chains

F. Harris, J. Delhalle, Joseph Delhalle, 1985 .

Influence of chemical substitution on energy band structure of polyfluoroethylenes

J. Delhalle, 1974 .

A floating spherical gaussian orbital model for polymers: I. general formalism and computational procedure

J. Delhalle, J. André, C. Demanet, 2009 .

Numerical Problems in Calculating Electronic Structure of One-Dimensional Chains

J. Delhalle, 1975 .

Ab initio calculations of all-trans octatetraene and some isoelectronic conjugated chains: equilibrium geometry and longitudinal electric polarizability

J. Delhalle, J. André, E. Younang, 1987 .