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Wei DONG

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A general approach based on morphological thermodynamics for a fluid confined in various porous media

C.Z. Qiao , H.R. Jiang , S.L. Zhao , W. Dong
Journal of Molecular Liquids, 2023, 392, pp.123345. ⟨10.1016/j.molliq.2023.123345⟩
Article dans une revue hal-04309481v1
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Nanoscale thermodynamics needs the concept of a disjoining chemical potential

Dong Wei
Nature Communications, 2023, 14 (1), pp.1824. ⟨10.1038/s41467-023-36970-7⟩
Article dans une revue hal-04305668v1
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Thermodynamics, statistical mechanics and the vanishing pore width limit of confined fluids

Dong Wei , T. Franosch , R. Schilling
Communications Physics, 2023, 6 (1), pp.161. ⟨10.1038/s42005-023-01255-4⟩
Article dans une revue hal-04305730v1

Augmented scaled particle theory for a hard disk fluid

C.Z. Qiao , S.L. Zhao , W. Dong
Journal of Molecular Liquids, 2022, 368, pp.120507. ⟨10.1016/j.molliq.2022.120507⟩
Article dans une revue hal-03871335v1

A cost-effective plan for global testing - An infection rate stratified, algorith guided, multiple-level, continuously pooled testing strategy

Tianshu Gu , Lan Yao , Xia Meng , J. Carolyn Graff , Donald Thomason
Science of the Total Environment, 2021, 765, pp.144251. ⟨10.1016/j.scitotenv.2020.144251⟩
Article dans une revue hal-03095053v1

Connect the Thermodynamics of Bulk and Confined Fluids: Confinement-Adsorption Scaling

Dong Wei , C. Qiao , S. Zhao , H. Liu , W. Dong
Langmuir, 2019, 35 (10), pp.3840-3847. ⟨10.1021/acs.langmuir.8b03126⟩
Article dans une revue hal-02376153v1

Fluids in porous media. IV. Quench effect on chemical potential

C. Qiao , S. L. Zhao , H. L. Liu , W. Dong
Journal of Chemical Physics, 2017, 146 (23), pp.234504. ⟨10.1063/1.4984773⟩
Article dans une revue hal-01671996v1

Erratum: “Fluids in porous media. III. Scaled particle theory” [J. Chem. Phys. 134 , 074503 (2011)]

T. Patsahan , M. Holovko , W. Dong
Journal of Chemical Physics, 2016, 144 (9), pp.099903. ⟨10.1063/1.4943572⟩
Article dans une revue hal-01896317v1

Scaled Particle Theory for Multicomponent Hard Sphere Fluids Confined in Random Porous Media

W. Chen , S. L. Zhao , M. Holovko , X. S. Chen , W. Dong
Journal of Physical Chemistry B, 2016, 120 (24), pp.5491 - 5504. ⟨10.1021/acs.jpcb.6b02957⟩
Article dans une revue hal-01671988v1

Membrane tube pearling induced by a coupling of osmotic pressure and nanoparticle adhesion

Falin Tian , Tongtao Yue , Wei Dong , Xianren Zhang
Molecular Physics, 2016, 114 (16-17), pp.2432 - 2445. ⟨10.1080/00268976.2016.1161855⟩
Article dans une revue hal-01671986v1

Cutting a chemical bond with demon's scissors: Mode- and bond-selective reactivity of methane on metal surfaces

A. Lozano , X.J. Shen , R. Moiraghi , W. Dong , H.F. Busnengo
Surface Science : A Journal Devoted to the Physics and Chemistry of Interfaces, 2015, 640, pp.25-35. ⟨10.1016/j.susc.2015.04.002⟩
Article dans une revue hal-01235926v1

Phase behavior under the averaging over disorder realizations

E.V. Vakarin , W. Dong , J.P. Badiali
Physica A: Statistical Mechanics and its Applications, 2015, 424, pp.294-299. ⟨10.1016/j.physa.2014.12.024⟩
Article dans une revue hal-01235974v1

Coverage effect on reactivity can be more complicated than what you believe: H2 dissociation on H-precovered Pd(111)

Y. M. Sun , W. Dong , X. H. Yan
Journal of Chemical Physics, 2014, 140 (24), pp.244703. ⟨10.1063/1.4883238⟩
Article dans une revue hal-01235930v1

Towards Bond Selective Chemistry from First Principles: Methane on Metal Surfaces

X. j. Shen , A. Lozano , W. Dong , H. f. Busnengo , X. h. Yan
Physical Review Letters, 2014, 112 (4), pp.046101. ⟨10.1103/PhysRevLett.112.046101⟩
Article dans une revue hal-01235933v1

Diffusion Rates for Hydrogen on Pd(111) from Molecular Quantum Dynamics Calculations

Thiago Firmino , Roberto Marquardt , Fabien Gatti , Dong Wei
Journal of Physical Chemistry Letters, 2014, 5, pp.4270. ⟨10.1021/jz502251w⟩
Article dans une revue hal-01089731v1

Chain-Length and Temperature Dependence of Self-Assembled Monolayers of Alkylthiolates on Au(111) and Ag(111) Surfaces

Y. Wang , J. G. Solano Canchaya , W. Dong , M. Alcamí , H. F. Busnengo
Journal of Physical Chemistry A, 2014, 118 (23), pp.4138-4146. ⟨10.1021/jp412285v⟩
Article dans une revue hal-01235932v1

Molecular dynamics simulations based on reactive force-fields for surface chemical reactions

X.J. Shen , Y. Xiao , W. Dong , X.H. Yan , H.F. Busnengo
Computational and Theoretical Chemistry, 2012, 990, pp.152 - 158. ⟨10.1016/j.comptc.2012.03.012⟩
Article dans une revue hal-01889598v1

Fluids in porous media. III. Scaled particle theory

T. Patsahan , M. Holovko , W. Dong
Journal of Chemical Physics, 2011, 134 (7), ⟨10.1063/1.3532546⟩
Article dans une revue hal-01889600v1

Molecular dynamics simulation of a complex surface reaction: The effect of coverage on H 2 dissociation on Pd(111)

Y. Xiao , W. Dong
Physical Review B: Condensed Matter and Materials Physics (1998-2015), 2011, 83 (12), ⟨10.1103/PhysRevB.83.125418⟩
Article dans une revue hal-01889609v1

Comment on “Reactive force fields for surface chemical reactions: A case study with hydrogen dissociation on Pd surfaces” [J. Chem. Phys. 132, 014704 (2010)]

X. Shen , W. Dong , Y. Xiao , X. Yan
Journal of Chemical Physics, 2011, 135 (16), ⟨10.1063/1.3652026⟩
Article dans une revue hal-01889611v1

Critical behavior of two-dimensional magnetic lattice gas model

L. Li , W. Chen , W. Dong , X. Chen
The European Physical Journal B: Condensed Matter and Complex Systems, 2011, 80 (2), pp.189 - 193. ⟨10.1140/epjb/e2011-10948-9⟩
Article dans une revue hal-01889621v1

Comment on “A Highly Accurate and Analytic Equation of State for a Hard Sphere Fluid in Random Porous Media”

W. Chen , W. Dong , M. Holovko , X. Chen
Journal of Physical Chemistry B, 2010, 114 (2), pp.1225 - 1225. ⟨10.1021/jp9106603⟩
Article dans une revue hal-01889628v1

Reactive force fields for surface chemical reactions: A case study with hydrogen dissociation on Pd surfaces

Y. Xiao , W. Dong , H. Busnengo
Journal of Chemical Physics, 2010, 132 (1), ⟨10.1063/1.3265854⟩
Article dans une revue hal-01889627v1

A Highly Accurate and Analytic Equation of State for a Hard Sphere Fluid in Random Porous Media

M. Holovko , W. Dong
Journal of Physical Chemistry B, 2009, 113 (18), pp.6360 - 6365. ⟨10.1021/jp809706n⟩
Article dans une revue hal-01889630v1

Fluids Confined in Porous Media: A Soft-Sponge Model †

W. Dong , V. Krakoviack , S. Zhao
Journal of Physical Chemistry C, 2007, 111 (43), pp.15910 - 15923. ⟨10.1021/jp073693f⟩
Article dans une revue hal-01906952v1

Breakdown of the Born-Oppenheimer Approximation in the F+ o-D2 -> DF + D Reaction

L. Che , Z. Ren , W. Dong , D. Dai , X. Wang
Science, 2007, 317 (5841), pp.1061-1064. ⟨10.1126/science.1144984⟩
Article dans une revue hal-03047406v1

Fluids in porous media. I. A hard sponge model

S. Zhao , W. Dong , Q. Liu
Journal of Chemical Physics, 2006, 125 (24), ⟨10.1063/1.2390703⟩
Article dans une revue hal-01906897v1

Thermodynamic pressure of a fluid confined in a random porous medium

W. Dong , X. Chen , W. Zheng
Physical Review E : Statistical, Nonlinear, and Soft Matter Physics, 2005, 72 (1), ⟨10.1103/PhysRevE.72.012201⟩
Article dans une revue hal-01906938v1

Surface temperature effects in dynamic trapping mediated adsorption of lignt molecules on metal surfaces: H2 on Pd(111) and Pd(110)

H. F. Busnengo , Antoine Salin , M.A. Di Césare , W. Dong
Physical Review B: Condensed Matter and Materials Physics (1998-2015), 2005, 72, pp.125411-1-125411-9. ⟨10.1103/physRevB.72.125411⟩
Article dans une revue hal-00110036v1

Trapping, Molecular Adsorption, and Precursors for Nonactivated Chemisorption

H. Busnengo , W. Dong , A. Salin
Physical Review Letters, 2004, 93 (23), ⟨10.1103/PhysRevLett.93.236103⟩
Article dans une revue hal-01907023v1

Density-functional theory calculations of the adsorption of Cl at perfect and defective Ag(111) surfaces

N. de Leeuw , C. Nelson , C. Catlow , P. Sautet , W. Dong
Physical Review B: Condensed Matter and Materials Physics (1998-2015), 2004, 69 (4), ⟨10.1103/PhysRevB.69.045419⟩
Article dans une revue hal-01896259v1

Diffusion of a hydrogen atom on the Pd(111) surface: quantum transition state wave packet approach

I. Nikitin , W. Dong , H.F. Busnengo , A. Salin
Surface Science : A Journal Devoted to the Physics and Chemistry of Interfaces, 2003, 547 (1-2), pp.149 - 156. ⟨10.1016/j.susc.2003.09.008⟩
Article dans une revue hal-01907044v1

Representation of the 6D potential energy surface for a diatomic molecule near a solid surface

H.F. Busnengo , A. Salin , W. Dong
Journal of Chemical Physics, 2000, 112, pp.7641-7651
Article dans une revue hal-00006965v1

Heterogeneous catalysis through subsurface sites

V. Ledentu , W. Dong , P. Sautet
Journal of the American Chemical Society, 2000, 122, pp.1796-1801
Article dans une revue hal-00006944v1

Six-dimensional classical dynamics of H2 dissociative adsorption on Pd(111)

H.F. Busnengo , W. Dong , A. Salin
Chemical Physics Letters, 2000, 320, pp.328-334
Article dans une revue hal-00006957v1

Fluid structure near heterogeneous surfaces

C. Delattre , W. Dong
Journal of Chemical Physics, 1999, 110, pp.570-576
Article dans une revue hal-00006905v1

H-induced reconstructions on Pd(110)

V. Ledentu , W. Dong , P. Sautet , G. Kresse , J. Hafner
Physical Review B: Condensed Matter and Materials Physics (1998-2015), 1998, 57, pp.12482-12491
Article dans une revue hal-00006719v1

Ab initio study of the dissociative adsorption of H2 on the Pd(110) surface

V. Ledentu , W. Dong , P. Sautet
Surface Science : A Journal Devoted to the Physics and Chemistry of Interfaces, 1998, 412/413, pp.518-526
Article dans une revue hal-00006729v1

Hydrogen adsorption on palladium: a comparative theoretical study of different surfaces

W. Dong , V. Ledentu , P. Sautet , A. Eichler , J. Hafner
Surface Science : A Journal Devoted to the Physics and Chemistry of Interfaces, 1998, 411, pp.123-136
Article dans une revue hal-00006728v1

Relation between the ultrasoft pseudopotential formalism and the LAPW method

W. Dong
Physical Review B: Condensed Matter and Materials Physics (1998-2015), 1998, 57, pp.4304-4307
Article dans une revue hal-00006725v1

H2 dissociative adsorption on Pd(111)

W. Dong , J. Hafner
Physical Review B: Condensed Matter and Materials Physics (1998-2015), 1997, 56, pp.15396-15403
Article dans une revue hal-00006615v1

Dissociative adsorption of H2 on the Pd(111) surface

W. Dong , G. Kresse , J. Hafner
Journal of Molecular Catalysis A: Chemical, 1997, 119, pp.69-76
Article dans une revue hal-00006616v1

A theoretical study of the H-induced reconstructions of the Pd(110) surface

W. Dong , V. Ledentu , P. Sautet , G. Kresse , J. Hafner
Surface Science : A Journal Devoted to the Physics and Chemistry of Interfaces, 1997, 377-379, pp.56-61
Article dans une revue hal-00006598v1

Long-time tail effect of the velocity correlation on diffusion-controlled reactions

W. Dong
Journal of Chemical Physics, 1997, 107, pp.9890-9893
Article dans une revue hal-00006614v1

Chemisorption of H on Pd(111): an ab initio approach with ultrasoft pseudopotentials

W. Dong , G. Kresse , J. Furthmuller , J. Hafner
Physical Review B: Condensed Matter and Materials Physics (1998-2015), 1996, 54, pp.2157-2166
Article dans une revue hal-00006437v1

Fluid diffusion through a porous solid: nonequilibrium molecular-dynamics simulation

W. Dong , H. Luo
Physical Review E : Statistical, Nonlinear, and Soft Matter Physics, 1995, 52, pp.801-804
Article dans une revue hal-00006148v1
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Mechanical route to the pressure of a fluid adsorbed in a random porous medium

W. Dong
Journal of Chemical Physics, 1995, 102, pp.6570-6573. ⟨10.1063/1.469372⟩
Article dans une revue hal-00006147v1

Density distribution of a fluid through a microporous solid : Monte Carlo simulation

W. Dong , B. Bigot
Physical Review E : Statistical, Nonlinear, and Soft Matter Physics, 1994, 49, pp.2184-2191
Article dans une revue hal-00005960v1

Diffusion-controlled reactions. II an approached based on a generealized diffusion aquation

W. Dong , J.C. Andre
Journal of Chemical Physics, 1994, 101, pp.299-306
Article dans une revue hal-00005958v1

Reaction mechanism for the isomerization of alkynyl and alkenyl phosphines to their corresponding low-coordinate compounds

W. Dong , Sylvie Lacombe-Lhoste , Danielle Gonbeau , G. Pfister-Guillouzo
New Journal of Chemistry, 1994, 18, pp.629-641
Article dans une revue hal-00005959v1

Gas-phase structure and stability of alkynylphosphines and allenylphosphines: Photoelectronic study

Sylvie Lacombe-Lhoste , W. Dong , G. Pfister-Guillouzo , J.C. Guillemin , J.M. Denis
Inorganic Chemistry, 1992, 31 (21), pp.4425--4427
Article dans une revue hal-01582245v1

Task Deployment Recommendation with Worker Availability

Dong Wei , Senjuti Basu Roy , Sihem Amer-Yahia
2020 IEEE 36th International Conference on Data Engineering (ICDE), Apr 2020, Dallas, France. pp.1806-1809, ⟨10.1109/ICDE48307.2020.00175⟩
Communication dans un congrès hal-02972565v1
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Recommending Deployment Strategies for Collaborative Tasks

Dong Wei , Senjuti Basu Roy , Sihem Amer-Yahia
SIGMOD/PODS '20: International Conference on Management of Data, 2020, Portland (virtual), United States. pp.3-17, ⟨10.1145/3318464.3389719⟩
Communication dans un congrès hal-02972571v1
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Optimizing Peer Learning in Online Groups with Affinities

Mohammadreza Esfandiari , Wei Dong , Sihem Amer-Yahia , Senjuti Basu Roy
the 25th ACM SIGKDD International Conference, Aug 2019, Anchorage, France. pp.1216-1226, ⟨10.1145/3292500.3330945⟩
Communication dans un congrès hal-02347162v1
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Research and Application of Space-Time Evolution of Soil Fertility Data Mining Based on Visualization

Wei Dong , Guifen Chen , Jian Jiang , Guowei Wang
5th Computer and Computing Technologies in Agriculture (CCTA), Oct 2011, Beijing, China. pp.359-367, ⟨10.1007/978-3-642-27278-3_38⟩
Communication dans un congrès hal-01361003v1

Liquid-vapor phase transition of Lennard-Jone mixtures in random porous media: Monte Carlo simulations

W. Dong
21st International Conference on Statistical Physics, STATPHYS 21, 15/07/01 - 21/07/01, 2001, Cancun, Mexico
Communication dans un congrès hal-00011521v1

Liquid-gas phase transition in random porous media: Monte Carlo simulations

W. Dong
Utretch University, Institute for Theoretical Physics, 28/09/00, 2000, Utretch, Netherlands
Communication dans un congrès hal-00011951v1

Kinetic description of diffusion-limited reactions: Noyes' theory revisited

H. van Beijeren , W. Dong , M.L. Bocquet
25th Middle European Cooperation in Statistical Physics - Recent Progress in the Statistical Physics Disordered Systems, Soft Matter and out-of-Equilibrium Phenomena, 9/03/00 - 11/03/00, 2000, Nancy, France
Communication dans un congrès hal-00010479v1

Dissociative adsorption of H2 on Pd(111): from energetics to dynamics

H.F. Busnengo , C. Crespos , W. Dong , A. Salin
10th International Conference on Solid Films and Surfaces, 9/07/00 - 13/07/00, 2000, Princeton, United States
Communication dans un congrès hal-00010296v1

Dissociative adsorption of H2 on Pd(111): from ab-initio calculations to dynamics

H.F. Busnengo , C. Crespos , W. Dong , A. Salin
8th International Conference on Theoretical Aspects of Heterogeneous Catalysis, 30/05/00 - 3/06/00, 2000, La Colle sur Loup, France
Communication dans un congrès hal-00010713v1

The role of molecular orientation in dissociative adsorption for a non-activated system: a case study on H2/Pd(111)

H.F. Busnengo , C. Crespos , W. Dong , A. Salin
13th International Conference on Inelastic Ion-Surface Collisions, 20/11/00 - 24/11/00, 2000, San Carlos de Bariloche, Argentina
Communication dans un congrès hal-00011511v1

Phase transition of fluids confined in random porous media: Monte Carlo simulations

J.K. Brennan , W. Dong
AIChE Annual Meeting, 31/10/99 - 5/11/99, 1999, Dallas, United States
Communication dans un congrès hal-00011019v1

Relation between recollisions, reaction kinetics and cage effect of chemical reactions in solution

W. Dong
IV Liquid Matter Conference, 3/07/99 - 7/07/99, 1999, Grenade, Spain
Communication dans un congrès hal-00010731v1

Milieux poreux : diffusion et transition de phases

W. Dong
Institut Charles Sadron, CNRS, 18/05/99, 1999, Strasbourg, France
Communication dans un congrès hal-00011880v1

Heterogeneous catalysis through subsurface sites

V. Ledentu , W. Dong , P. Sautet
217th American Chemical Society National Meeting and Exposition Program, 21/03/99 - 25/03/99, 1999, Anaheim, United States
Communication dans un congrès hal-00011449v1

Recent advances and prospects in the study of diffusion reactions

W. Dong
Annual Suzuki Lecture, Chemistry Department, Doshisha University, 6/02/98, 1998, Kyoto, Japan
Communication dans un congrès hal-00011843v1

Comparative study of fluid density distribution near plane and heterogeneous surfaces

W. Dong
3rd International Symposium on Effects of Surface Heterogeneity in Adsorption and Catalysis on Solids, 9/08/98 - 16/08/98, 1998, Torun, Poland
Communication dans un congrès hal-00010550v1

Hydrogenation of CH3 on NI(111). Why are surface hydrogens more reactive ?

V. Ledentu , W. Dong , P. Sautet
14th International Vacuum Congress, IVC-14, 31/08/98 - 4/09/98, 1998, Birmingham, United Kingdom
Communication dans un congrès hal-00010389v1

Quantitative characterization of cage effect for reactions in solution

W. Dong , H. van Beijeren , M.L. Bocquet
20th IUPAP Conference on Statistical Physics, STAPHYS 20, 20/07/98 - 25/07/98, 1998, Paris, France
Communication dans un congrès hal-00010458v1

"Relation entre la méthode du pseudopotentiel "ultrasoft" et la méthode LAPW"

W. Dong
Journées de la Structure Electronique dans les Matériaux, 27/05/98 - 28/05/98, 1998, Lille, France
Communication dans un congrès hal-00011020v1

Adsorption dissociative de H2 sur Pd (111)

W. Dong
Laboratoire de Physicochimie Théorique, Université Bordeaux 1, 27/11/97, 1997, Bordeaux, France
Communication dans un congrès hal-00011832v1

Dissociative adsorption of H2 on the Pd(111) and Pd(110) surfaces

W. Dong , V. Ledentu , P. Sautet , J. Hafner
QTS 97, Symposium on Quantum and Simulation of Bulk, Surface and interface Phenomena, 15/06/97 - 18/06/97, 1997, Raleigh, United States
Communication dans un congrès hal-00010929v1

Study of H/Pd(110)-(1x2) surface reconstitutions by ab initio calculations

W. Dong , V. Ledentu , P. Sautet , G. Kresse , J. Hafner
16th European Conference on Surface Science, ECOSS-16, 9/09/96 - 13/09/96, 1996, Genova, Italy
Communication dans un congrès hal-00010410v1

Long-time tail effect of velocity correlation on diffusion-controlled reactions

W. Dong
3rd Liquid Matter Conference, 6/07/96 - 10/07/96, 1996, Norwich, Royaume-Uni
Communication dans un congrès hal-00010536v1

Etude théorique de la chimisorption de l'hydrogène sur Pd(110) et de la reconstruction de la surface

V. Ledentu , W. Dong , P. Sautet
Journées francophones des Jeunes physico-Chimistes, 16/07/96 - 18/07/96, 1996, Lille, France
Communication dans un congrès hal-00010896v1

Fluid diffusion through a porous solid: nonequilibrium molecular-dynamics simulations

W. Dong
Adsorption, Phase Transitions and Transport in Porous Materials, CECAM, 11/09/95 - 15/09/95, 1995, Lyon, France
Communication dans un congrès hal-00011275v1

Etudes théoriques des réactions controllées par la diffusion

W. Dong
Département de Chimie Physique des Réactions, URA 328, ENSIC, 23/02/94, 1994, Nancy, France
Communication dans un congrès hal-00011668v1