J. C. Love, L. A. Estroff, J. K. Kriebel, R. G. Nuzzo, and G. M. Whitesides, Self-assembled monolayers of thiolates on metals as a form of nanotechnology, Chemical Reviews, pp.105-1103, 2005.

T. D. Dunbar, M. T. Cygan, L. A. Bumm, G. S. Mccarty, T. P. Burgin et al., Combined Scanning Tunneling Microscopy and Infrared Spectroscopic Characterization of Mixed Surface Assemblies of Linear Conjugated Guest Molecules in Host Alkanethiolate Monolayers on Gold, The Journal of Physical Chemistry B, vol.104, issue.20, pp.4880-4893, 2000.
DOI : 10.1021/jp993724+

R. K. Smith, P. A. Lewis, and P. S. Weiss, Patterning self-assembled monolayers, Progress in Surface Science, vol.75, issue.1-2, pp.75-76, 2004.
DOI : 10.1016/j.progsurf.2003.12.001

C. D. Bain, E. B. Troughton, Y. T. Tao, J. Evall, G. M. Whitesides et al., ChemInform Abstract: Formation of Monolayer Films by the Spontaneous Assembly of Organic Thiols from Solution Onto Gold., ChemInform, vol.111, issue.15, pp.111-321, 1989.
DOI : 10.1002/chin.198915064

J. P. Folkers, P. E. Laibinis, and G. M. Whitesides, Self-Assembled Monolayers of Alkanethiols on Gold - Comparisons of Monolayers Containing Mixtures of Short-Chain and Long-Chain Constituents with Ch3 and Ch2oh Terminal Groups, Langmuir, pp.8-1330, 1992.

J. P. Folkers, P. E. Laibinis, G. M. Whitesides, and J. Deutch, Phase behavior of two-component self-assembled monolayers of alkanethiolates on gold, The Journal of Physical Chemistry, vol.98, issue.2, pp.98-563, 1994.
DOI : 10.1021/j100053a035

F. Tielens, V. Humblot, and C. Pradier, Exploring the reactivity of mixed ?-functionalized undecanethiol self-assembled monolayers?A DFT study, International Journal of Quantum Chemistry, vol.109, issue.10, pp.1792-1795, 2008.
DOI : 10.1002/qua.21600

URL : https://hal.archives-ouvertes.fr/hal-01361371

A. Santos, J. A. Millan, and S. C. Glotzer, Facetted patchy particles through entropy-driven patterning of mixed ligand SAMS, Nanoscale, vol.8, issue.8, pp.2640-2650, 2012.
DOI : 10.1039/c2nr11737a

T. Sawaguchi, Y. Sato, and F. Mizutani, In situ STM imaging of individual molecules in two-component selfassembled monolayers of 3-mercaptopropionic acid and 1-decanethiol on, Au Journal of Electroanalytical Chemistry, issue.111, pp.496-50, 2001.

I. Hehn, S. Schuster, T. Waechter, T. Abu-husein, A. Terfort et al., Employing X-ray Photoelectron Spectroscopy for Determining Layer Homogeneity in Mixed Polar Self-Assembled Monolayers, The Journal of Physical Chemistry Letters, vol.7, issue.15, pp.2994-3000, 2016.
DOI : 10.1021/acs.jpclett.6b01096

URL : http://doi.org/10.1021/acs.jpclett.6b01096

A. Walther and A. H. Mueller, Janus particles, Soft Matter, vol.47, issue.4, pp.663-668, 2008.
DOI : 10.1039/b718131k

D. Suzuki and H. Kawaguchi, Janus particles with a functional gold surface for control of surface plasmon resonance, Colloid and Polymer Science, pp.1471-1476, 2006.

S. Kim, S. Jeon, W. C. Jeong, H. S. Park, and S. Yang, Optofluidic Synthesis of Electroresponsive Photonic Janus Balls with Isotropic Structural Colors, Advanced Materials, vol.13, pp.20-4129, 2008.
DOI : 10.1002/adma.200801167

M. D. Mcconnell, M. J. Kraeutler, S. Yang, and R. J. Composto, Patchy and Multiregion Janus Particles with Tunable Optical Properties, Nano Letters, vol.10, issue.2, pp.10-603, 2010.
DOI : 10.1021/nl903636r

J. N. Anker and R. Kopelman, Magnetically modulated optical nanoprobes, Applied Physics Letters, vol.82, issue.7, pp.1102-1104, 2003.
DOI : 10.1038/nrd817

J. Kim, D. Lee, H. C. Shum, and D. A. Weitz, Colloid Surfactants for Emulsion Stabilization, Advanced Materials, vol.288, issue.17, p.3239, 2008.
DOI : 10.1002/adma.200800484

N. Glaser, D. J. Adams, A. Boeker, and G. Krausch, Janus Particles at Liquid?Liquid Interfaces, Langmuir, vol.22, issue.12, pp.22-5227, 2006.
DOI : 10.1021/la060693i

A. Synytska, R. Khanum, L. Ionov, C. Cherif, and C. Bellmann, Water-Repellent Textile via Decorating Fibers with Amphiphilic Janus Particles, ACS Applied Materials & Interfaces, vol.3, issue.4, pp.1216-1220, 2011.
DOI : 10.1021/am200033u

J. R. Millman, K. H. Bhatt, B. G. Prevo, and O. D. Velev, Anisotropic particle synthesis in dielectrophoretically controlled microdroplet reactors, Nature Materials, vol.38, issue.1, pp.98-102, 2005.
DOI : 10.1038/nmat1270

C. Vilain, F. Goettmann, A. Moores, P. L. Floch, and C. Sanchez, Study of metal nanoparticles stabilised by mixed ligand shell: a striking blue shift of the surface-plasmon band evidencing the formation of Janus nanoparticles, Journal of Materials Chemistry, vol.119, issue.33, pp.17-3509, 2007.
DOI : 10.1039/b706613a

URL : https://hal.archives-ouvertes.fr/hal-00334748

F. Cardinaux, A. Stradner, P. Schurtenberger, F. Sciortino, and E. Zaccarelli, Modeling equilibrium clusters in lysozyme solutions, Europhysics Letters (EPL), vol.77, issue.4, p.77, 2007.
DOI : 10.1209/0295-5075/77/48004

URL : http://arxiv.org/abs/cond-mat/0607264

E. Sanz, C. Valeriani, T. Vissers, A. Fortini, M. E. Leunissen et al., Out-of-equilibrium processes in suspensions of oppositely charged colloids: liquid-to-crystal nucleation and gel formation, Journal of Physics: Condensed Matter, vol.20, issue.49, p.20, 2008.
DOI : 10.1088/0953-8984/20/49/494247

E. Zaccarelli, S. M. Liddle, and W. C. Poon, On polydispersity and the hard sphere glass transition, Soft Matter, vol.111, issue.2, pp.324-330, 2015.
DOI : 10.1039/C4SM02321H

J. Colombo and M. Dijkstra, Effect of quenched size polydispersity on the fluid-solid transition in charged colloidal suspensions, The Journal of Chemical Physics, vol.134, issue.15, p.134, 2011.
DOI : 10.1103/PhysRevLett.104.118302

A. M. Somoza, E. Chacon, L. Mederos, P. Tarazona, A. Model et al., A model for membranes, vesicles and micelles in amphiphilic systems, Journal of Physics: Condensed Matter, vol.7, issue.29, pp.5753-5776, 1995.
DOI : 10.1088/0953-8984/7/29/005

C. Ma, H. Wu, Z. H. Huang, R. H. Guo, M. B. Hu et al., A Filled-Honeycomb- Structured Crystal Formed by Self-Assembly of a Janus Polyoxometalate-Silsesquioxane (POM-POSS) Co- Cluster, Angewandte Chemie-International Edition, pp.54-15699, 2015.

D. Costa, M. Smerieri, I. Tranca, L. Savio, L. Vattuone et al., DFT Atomistic Thermodynamics Applied To Elucidate the Driving Force behind Glutamic Acid Self-Assemblies on Silver (100) Surface, The Journal of Physical Chemistry C, vol.118, issue.51, pp.118-29874, 2014.
DOI : 10.1021/jp509249x

URL : https://hal.archives-ouvertes.fr/hal-01275059

I. Tranca, M. Smerieri, L. Savio, L. Vattuone, D. Costa et al., Unraveling the Self-Assembly of the (S)-Glutamic Acid "Flower, Langmuir, pp.29-7876, 2013.
URL : https://hal.archives-ouvertes.fr/hal-01361357

V. Humblot, F. Tielens, N. B. Luque, H. Hampartsoumian, C. Methivier et al., Characterization of Two-Dimensional Chiral Self-Assemblies L-and D-Methionine on, Au Langmuir, issue.111, pp.30-203, 2014.
URL : https://hal.archives-ouvertes.fr/hal-01121198

F. Tielens, V. Humblot, and C. Pradier, Elucidation of the low coverage chiral adsorption assembly of l-lysine on Cu(110) surface: A theoretical study, Surface Science, vol.602, issue.5, pp.602-1032, 2008.
DOI : 10.1016/j.susc.2007.12.033

URL : https://hal.archives-ouvertes.fr/hal-01361368

F. Tielens and E. Santos, AuS and SH Bond Formation/Breaking during the Formation of, Alkanethiol SAMs on Au Journal of Physical Chemistry C, issue.111, pp.114-9444, 2010.
URL : https://hal.archives-ouvertes.fr/hal-00604807

H. Guesmi, N. B. Luque, E. Santos, and F. Tielens, Does the S?H Bond Always Break after Adsorption of an Alkylthiol on Au(111)?, Chemistry - A European Journal, vol.79, issue.6, pp.1402-1408, 2016.
DOI : 10.1002/chem.201604574

URL : https://hal.archives-ouvertes.fr/hal-01397010

A. D. Souza, I. Rungger, R. B. Pontes, A. R. Rocha, A. J. Da-silva et al., Stretching of BDT-gold molecular junctions: thiol or thiolate termination?, Nanoscale, vol.131, issue.23, pp.6-14495, 2014.
DOI : 10.1039/C4NR04081C

F. Schreiber, Structure and growth of self-assembling monolayers, Progress in Surface Science, vol.65, issue.5-8, pp.151-256, 2000.
DOI : 10.1016/S0079-6816(00)00024-1

H. Hakkinen, M. Walter, and H. Gronbeck, Divide and Protect:? Capping Gold Nanoclusters with Molecular Gold?Thiolate Rings, The Journal of Physical Chemistry B, vol.110, issue.20, pp.9927-9931, 2006.
DOI : 10.1021/jp0619787

P. Maksymovych, D. C. Sorescu, and J. T. Yates, Gold-adatom-mediated bonding in self-assembled shortchain alkanethiolate species on the Au(111) surface, Physical Review Letters, p.97, 2006.

A. Bencini, G. Rajaraman, F. Totti, and M. Tusa, Modeling thiols on Au(111): Structural, thermodynamic and magnetic properties of simple thiols and thiol-radicals, Superlattices and Microstructures, vol.46, issue.1-2, pp.46-50, 2009.
DOI : 10.1016/j.spmi.2008.12.006

G. Rajaraman, A. Caneschi, D. Gatteschi, and F. Totti, A periodic mixed gaussians?plane waves DFT study on simple thiols on Au(111): adsorbate species, surface reconstruction, and thiols functionalization, Physical Chemistry Chemical Physics, vol.7, issue.9, pp.13-3886, 2011.
DOI : 10.1039/c0cp02042g

G. Kresse and J. Furthmuller, total-energy calculations using a plane-wave basis set, Physical Review B, vol.2, issue.16, pp.11169-11186, 1996.
DOI : 10.1016/0927-0256(94)90105-8

G. Kresse and D. Joubert, From ultrasoft pseudopotentials to the projector augmented-wave method, Physical Review B, vol.9, issue.3, pp.1758-1775, 1999.
DOI : 10.1103/PhysRevB.55.13479

J. P. Perdew, K. Burke, and M. Ernzerhof, Generalized Gradient Approximation Made Simple, Physical Review Letters, vol.80, issue.18, pp.77-3865, 1996.
DOI : 10.1063/1.446965

J. P. Perdew, K. Burke, and M. Ernzerhof, Generalized Gradient Approximation Made Simple, Physical Review Letters, vol.80, issue.18, pp.78-1396, 1996.
DOI : 10.1063/1.446965

F. Tielens, C. Gervais, J. F. Lambert, F. Mauri, and D. Costa, Ab Initio Study of the Hydroxylated Surface of Amorphous Silica: A Representative Model, Chemistry of Materials, vol.20, issue.10, pp.20-3336, 2008.
DOI : 10.1021/cm8001173

URL : https://hal.archives-ouvertes.fr/hal-01361369

M. Calatayud, F. Tielens, and F. D. Proft, Reactivity of gas-phase, crystal and supported V2O5 systems studied using density functional theory based reactivity indices, Chemical Physics Letters, vol.456, issue.1-3, pp.456-59, 2008.
DOI : 10.1016/j.cplett.2008.03.007

URL : https://hal.archives-ouvertes.fr/hal-01361372

T. V. De-bocarme, T. D. Chau, F. Tielens, J. Andres, P. Gaspard et al., Oxygen adsorption on gold nanofacets and model clusters, Journal of Chemical Physics, p.125, 2006.

F. Tielens, J. Andres, T. D. Chau, T. V. De-bocarme, N. Kruse et al., Molecular oxygen adsorption on electropositive nano gold tips, Chemical Physics Letters, vol.421, issue.4-6, pp.421-433, 2006.
DOI : 10.1016/j.cplett.2006.02.006

URL : https://hal.archives-ouvertes.fr/hal-01361380

F. Tielens, M. Calatayud, S. Dzwigaj, and M. Che, What do vanadium framework sites look like in redox model silicate zeolites?, Microporous and Mesoporous Materials, vol.119, issue.1-3, pp.137-143, 2009.
DOI : 10.1016/j.micromeso.2008.10.007

URL : https://hal.archives-ouvertes.fr/hal-01361361

F. Tielens, M. Trejda, M. Ziolek, and S. Dzwigaj, Nature of vanadium species in V substituted zeolites: A combined experimental and theoretical study, Catalysis Today, vol.139, issue.3, pp.139-221, 2008.
DOI : 10.1016/j.cattod.2008.04.007

URL : https://hal.archives-ouvertes.fr/hal-01361370

P. E. Blochl, O. Jepsen, and O. K. Andersen, Improved tetrahedron method for Brillouin-zone integrations, Physical Review B, vol.3, issue.23, pp.16223-16233, 1994.
DOI : 10.1088/0953-8984/3/33/002

P. E. Blochl, Projector augmented-wave method, Physical Review B, vol.44, issue.24, pp.17953-17979, 1994.
DOI : 10.1103/PhysRevB.44.13063

S. Grimme, Semiempirical GGA-type density functional constructed with a long-range dispersion correction, Journal of Computational Chemistry, vol.10, issue.15, pp.1787-1799, 2006.
DOI : 10.1002/jcc.20495

S. Grimme, J. Antony, S. Ehrlich, and H. Krieg, parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu, The Journal of Chemical Physics, vol.16, issue.15, p.132, 2010.
DOI : 10.1039/b803508c

K. Toyoda, I. Hamada, K. Lee, S. Yanagisawa, and Y. Morikawa, Density functional theoretical study of pentacene/noble metal interfaces with van der Waals corrections: Vacuum level shifts and electronic structures, The Journal of Chemical Physics, vol.132, issue.13, p.132, 2010.
DOI : 10.1103/PhysRevB.80.245427

J. Slawinska, P. Dabrowski, and I. Zasada, Doping of graphene by a Au(111) substrate: Calculation strategy within the local density approximation and a semiempirical van der Waals approach, Physical Review B, p.83, 2011.

F. Schreiber, Self-assembled monolayers: from ?simple? model systems to biofunctionalized interfaces, Journal of Physics: Condensed Matter, vol.16, issue.28, p.881, 2004.
DOI : 10.1088/0953-8984/16/28/R01

C. Vericat, M. E. Vela, and R. C. Salvarezza, Self-assembled monolayers of alkanethiols on Au(111): surface structures, defects and dynamics, Physical Chemistry Chemical Physics, vol.117, issue.285, pp.3258-3268, 2005.
DOI : 10.1039/b505903h

N. B. Luque, E. Santos, J. Andres, and F. Tielens, Effect of Coverage and Defects on the Adsorption of Propanethiol on Au(111) Surface: A Theoretical Study, Langmuir, vol.27, issue.23, pp.27-14514, 2011.
DOI : 10.1021/la202861s

URL : https://hal.archives-ouvertes.fr/hal-00670100

X. Wu, M. C. Vargas, S. Nayak, V. Lotrich, and G. Scoles, Towards extending the applicability of density functional theory to weakly bound systems, The Journal of Chemical Physics, vol.115, issue.19, pp.115-8748, 2001.
DOI : 10.1063/1.479570

P. Pengo, S. Polizzi, M. Battagliarin, L. Pasquato, and P. , Scrimin, Synthesis, characterization and properties of water-soluble gold nanoparticles with tunable core size, Journal of Materials Chemistry, pp.13-2471, 2003.

M. Kleinert, T. Winkler, A. Terfort, and T. K. Lindhorst, A modular approach for the construction and modification of glyco-SAMs utilizing 1,3-dipolar cycloaddition, Organic & Biomolecular Chemistry, vol.117, issue.12, pp.2118-2132, 2008.
DOI : 10.1039/b801595c

E. E. Foos, A. W. Snow, M. E. Twigg, and M. G. Ancona, Thiol-Terminated Di-, Tri-, and Tetraethylene Oxide Functionalized Gold Nanoparticles:? A Water-Soluble, Charge-Neutral Cluster, Chemistry of Materials, vol.14, issue.5, pp.14-2401, 2002.
DOI : 10.1021/cm020007a

E. Mete, M. Yortanl?, and M. F. Danisman, A van der Waals DFT study of chain length dependence of alkanethiol adsorption on Au(111): physisorption vs. chemisorption, Phys. Chem. Chem. Phys., vol.112, issue.611, 2017.
DOI : 10.1021/ja00158a012

F. Tielens, D. Costa, V. Humblot, and C. M. Pradier, Characterization of omega-functionalized undecanethiol mixed self-assembled monolayers on Au(111): A combined polarization modulation infrared reflection-absorption spectroscopy/X-ray photoelectron spectroscopy/periodic density functional theory study, Journal of Physical Chemistry C, pp.112-182, 2008.
URL : https://hal.archives-ouvertes.fr/hal-01361366

F. Tielens, V. Humblot, C. M. Pradier, M. Calatayud, and F. Illas, Stability of Binary SAMs Formed by omega- Acid and Alcohol Functionalized Thiol Mixtures, Langmuir, pp.25-9980, 2009.
URL : https://hal.archives-ouvertes.fr/hal-01361365

M. Rodriguez-castillo, D. Laurencin, F. Tielens, A. Van-der-lee, S. Clement et al., Reactivity of gold nanoparticles towards N-heterocyclic carbenes, Dalton Transactions, vol.6, issue.416, pp.43-5978, 2014.
DOI : 10.1039/c3dt53579g

E. Bedford, V. Humblot, C. Methivier, C. Pradier, F. Gu et al., An Experimental and Theoretical Approach to Investigate the Effect of Chain Length on Aminothiol Adsorption and Assembly on Gold, Chemistry - A European Journal, vol.115, issue.568, pp.14555-14561, 2015.
DOI : 10.1002/chem.201500653

URL : https://hal.archives-ouvertes.fr/hal-01275048

C. Vericat, M. E. Vela, G. Benitez, P. Carro, and R. C. Salvarezza, Self-assembled monolayers of thiols and dithiols on gold: new challenges for a well-known system, Chemical Society Reviews, pp.39-1805, 2010.

V. De-renzi, R. Di-felice, D. Marchetto, R. Biagi, U. Del-pennino et al., Ordered (3 ? 4) High-Density Phase of Methylthiolate on Au(111), The Journal of Physical Chemistry B, vol.108, issue.1, pp.16-20, 2004.
DOI : 10.1021/jp0365054

P. K. Ghorai and S. C. Glotzer, Atomistic Simulation Study of Striped Phase Separation in Mixed-Ligand Self-Assembled Monolayer Coated Nanoparticles, The Journal of Physical Chemistry C, vol.114, issue.45, pp.114-19182, 2010.
DOI : 10.1021/jp105013k

X. Liu, M. Yu, H. Kim, M. Mameli, and F. Stellacci, Determination of monolayer-protected gold nanoparticle ligand?shell morphology using NMR, Nature Communications, vol.134, 2012.
DOI : 10.1038/ncomms2155

H. Kim, R. P. Carney, J. Reguera, Q. K. Ong, X. Liu et al., Synthesis and Characterization of Janus Gold Nanoparticles, Advanced Materials, vol.112, issue.28, pp.24-3857, 2012.
DOI : 10.1002/adma.201200926

URL : https://infoscience.epfl.ch/record/180905/files/3857_ftp.pdf

X. W. Ge, P. C. Ke, T. P. Davis, and F. Ding, A Thermodynamics Model for the Emergence of a Stripe-like Binary SAM on a Nanoparticle Surface, Small, vol.22, issue.37, pp.11-4894, 2015.
DOI : 10.1002/smll.201501049

H. Hinterwirth, S. Kappel, T. Waitz, T. Prohaska, W. Lindner et al., Quantifying Thiol Ligand Density of Self-Assembled Monolayers on Gold Nanoparticles by Inductively Coupled Plasma???Mass Spectrometry, ACS Nano, vol.7, issue.2, pp.1129-1136, 2013.
DOI : 10.1021/nn306024a

L. F. Peiretti, P. Quaino, and F. Tielens, Competition between Two High-Density Assemblies of Poly(phenyl)thiols on Au(111), The Journal of Physical Chemistry C, vol.120, issue.44, pp.120-25462, 2016.
DOI : 10.1021/acs.jpcc.6b08977

URL : https://hal.archives-ouvertes.fr/hal-01396670

C. Goldmann, F. Ribot, L. F. Peiretti, P. Quaino, F. Tielens et al., Quantified Binding Scale of Competing Ligands at the Surface of Gold Nanoparticles: The Role of Entropy and Intermolecular Forces, Small, vol.8, issue.20
DOI : 10.1021/nn406109v

URL : https://hal.archives-ouvertes.fr/hal-01517528