Colored Design

Publications

    2024

  1. Compressibility, diffusivity and elasticity in relationship with ionic conduction: an atomic scale description of densified Li2S-SiS2 glasses, M. Micoulaut, L.-M. Poitras, S. Sørensen, H. Flores-Ruiz, G.G. Naumis, Journal of the American Ceramic Society,
  2.  
  3. Flexibility induced ionic conductors as a new paradigm for enhanced fast-ion transport in glasses, M. Micoulaut,
  4.  
  5. Pockets, jumps and filaments : classifying ionic motion and determining the role of structure in electrochemical properties of 2Li2S-GeS2 superionic glasses M. Micoulaut, Journal of Physics: Condensed Matter 36 (2024) 195703, pdf file.
  6.  
  7. Molecular dynamics simulations of SiS2-Li2S-LiI fast ion glasses: increase of conductivity is driven by network atoms, M. Micoulaut, (2024) .
  8.  
  9. Explaining an anomalous pressure dependence of shear modulus in germanate glasses based on Reverse Monte Carlo modelling S. Sørensen, X. Ge, M. Micoulaut, Y. Shi, M. Juelsholt, K.M. Jensen, J. Neuefeind, M. Bockowski, M. Smedskjaer, Journal of Materials Science and technology 192 (2024) 54, pdf file.
  10.  
  11. EGraFFBench: Evaluation of Equivariant Graph Neural Network Force Fields for Atomistic Simulations, V. Bihani, S. Mannan, U. Pratiush, T. Du, C. Zhimin, S. Miret, M. Micoulaut, M. Smedskjaer, S. Ranu, N. Krishnan, Digital Discovery (2024) pdf file.
  12.  

    2023

  13. Quantitative assessment of network depolymerization in archetypal superionic glasses and its relationship with ion conduction: A case study on Na2S-GeS2, M. Micoulaut, A. Piarristeguy, O. Masson, L.-M. Poitras, R. Escalier, A. Kachmar, A. Pradel, Physical Review B 108, 144205 (2023) pdf file.
  14.  
  15. Establishement of an empirical force-field for crystalline and amorphous Li2S-SiS2 electrolytes, L.-M. Poitras, M. Micoulaut, Physical Review B 107, 214205 (2023) pdf file.
  16.  
  17. Evidence for complex dynamics in glassy fast ion conductors: the case of sodium thiosilicates S. Sørensen, M. Smedskjaer, M. Micoulaut, Journal of Physical Chemistry B 127, 10179 (2023) pdf file.
  18.  
  19. Impact of Short-Range Order and Tetrahedral Germanium on Electronic and Dielectric Properties in Phase Change Materials, M. Micoulaut, H. Flores-Ruiz, Journal of the American Ceramic Society 106, 2260 (2023), pdf file.
  20.  
  21. Glass transition, topology, and elastic models of Se-based glasses, R. Chbeir, A. Welton, M. Burger, S. Chakravarty, S. Dash, S. Bhosle, K. Gunasekera, B.S. Almutairi, B. Goodman, M. Micoulaut, P. Boolchand, Journal of the American Ceramic Society 106, 3277 (2023) pdf file.
  22.  
  23. Topological ordering and water-like anomalies during flexible to rigid transitions in disordered networks, M. Micoulaut, Comptes-Rendus Physique (2023) pdf file.
  24.  
  25. Simuler le verre, C. Le Losq, M. Micoulaut, Reflets de la physique 34 (2023) 74, pdf file.
  26. 2022

  27. Structure-property relationship and chemical durability of magnesium-containing borosilicate glasses : insight from topological constraints, N. Bisbrouck, M. Micoulaut, J.-M. Delaye, S. Gin, F. Angeli, NPJ Materials Degradation 6, 58 (2022) pdf file.
  28.  
  29. Crucial Role of S8-Rings in Structural, Relaxation, Vibrational and Electronic Properties of Liquid Sulfur close to the lambda Transition, H. Flores-Ruiz, M. Micoulaut, Journal of Chemical Physics 157, 054507 (2022) pdf file.
  30.  
  31. Structural Properties of Chalcogenide Glasses and the Isocoordination Rule : Disentangling Effects from Chemistry and Network Topology, M. Micoulaut, I Pethes, P. Jovari, L. Pusztai, M. Krbal, T. Wagner, V. Prokop, S. Michalik, K. Ikeda, I. Kaban, Physical Review B 106, 014206 (2022) pdf file.
  32.  
  33. Topological Constraint Theory of Glass: Counting Constraints by Molecular Dynamics Simulations, Y. Hu, H. Liu, K. Yang, Q. Zhou, C.G. Hoover, N.M. Anoop Krishnan, M.M. Smedskjaer, M. Micoulaut, L. Guo, M. Bauchy, in Atomistic Simulations of Glasses: Fundamentals and Applications, Ed. J. Du, A Cormack (Wiley, 2022) p. 123 pdf file.
  34.  
  35. Topology and rigidity of silicate melts and glasses, M Micoulaut, M Bauchy, Reviews in Mineralogy and Geochemistry 87 (2022) 163, pdf file.
  36. 2021

  37. Search for a possible flexible-to-rigid transition in models of phase change materials, M. Micoulaut, H. Flores-Ruiz, Physical Review B 103, 134206 (2021) pdf file.
  38.  
  39. Alteration of Structure, Electronic, and Vibrational Properties of amorphous GeTe by Selenium substitution: an Experimentally Constrained Density Functional Study, M. Micoulaut, A. Piarristeguy, O. Masson, R. Escalier, H. Flores-Ruiz, A. Pradel, Physical Review B 104, 144204 (2021) pdf file.
  40.  
  41. Influence of Magnesium on the Structure of Complex Multicomponent Silicates : Insight from Molecular Simulations and Neutron Scattering Experiments, N. Bisbrouck, M. Micoulaut, J.-M. Delaye, M. Bertani, T. Charpentier, S. Gin, F. Angeli, Journal of Physical Chemistry B 125, 11761 (2021) pdf file.
  42.  
  43. Noble Gas in Densified Liquid and Amorphous Silica and Thermodynamic Conditions for the Emergence of Bubbles, M. Micoulaut, O. Laurent, Journal of Chemical Physics 155, 054504 (2021) pdf file.
  44.  
  45. Obtaining glasses in the extremely crystallizing Ge-Sb-Te phase change material, A. Piarristeguy, M. Micoulaut, R. Escalier, G. Silly, M.-V. Coulet, A. Pradel, Journal of Non-Crystalline Solids 352, 120730 (2021) pdf file.
  46.  
  47. Impact of magnesium on the structure of aluminoborosilicate glasses: A Solid-State NMR study, N. Bisbrouck, M. Bertani, F. Angeli, T. Charpentier, D. de Ligny, J.-M. Delaye, S. Gin, M. Micoulaut, Journal of the American Ceramic Society 104, 4518 (2021) pdf file.
  48.  
  49. Melt dynamics, nature of glass transition and topological phases of equimolar GexAsxS100-2x ternary glasses, B.S. Almutairi, S. Chakravarty, R. Chbeir, P. Boolchand, M. Micoulaut, Journal of Alloys and Compounds 868, 159101 (2021) pdf file.
  50. 2020

  51. Complex dynamics in nanoscale phase separated supercooled liquids, S. Cazzato, A. Chrissanthopoulos, M. Micoulaut, S.N. Yannopoulos, Physical Review Research 2, 032007(R) (2020) pdf file
  52.  
  53. Tetrahedral complexity in amorphous networks : a possible clue for the unique properties of phase-change materials, M. Micoulaut, Hugo Flores-Ruiz, A. Pradel, A. Piarristeguy, Physica Status Solidi B 15, 2000490 (2020) pdf file
  54.  
  55. Understanding the strain rate sensitivity of nanocrystalline copper using molecular dynamics, A.Rida, M. Micoulaut, E. Rouhaud, A. Makke, Computational Materials Science 172, 109294 (2020) pdf file.
  56.  
  57. Dynamic and stress signatures of the rigid intermediate phase in glass-forming liquids, W. Song, X. Li, M. Wang, M. Bauchy, M. Micoulaut, Journal of Chemical Physics 152, 221101 (2020) pdf file.
  58.  
  59. Progress, Challenges and Rewards in Probing Melt Dynamics, Configurational Entropy change and Topological Phases of Group V and Group IV based Multicomponent Sulfide glasses, S. Chakravarty, B. Almutairi, R. Chbeir, S. Chakraborty, M. Bauchy, M. Micoulaut, P. Boolchand, Physica Status Solidi B 257, 2000116 (2020) pdf file.
  60.  
  61. Glass transition and rigidity in the aging linear harmonic oscillator model, H. Fores-Ruiz, G.G. Naumis, M. Micoulaut, Journal of Non-Crystalline Solids 540, 120127 (2020) pdf file.
  62.  
  63. Topology of disordered networks and their applications, P. Boolchand, M. Micoulaut, Frontiers in Materials 7, 175 (2020) pdf file.
  64.  
  65. Glass transition and relaxation of chalcogenides : insight from structure, topology and rigidity, M. Micoulaut, in Amorphous Chalcogenides: Structure, Properties, Modeling and Applications, Ed. A. V. Kolobov, K. Shimakawa (World Scientific, 2020) p. 10.
  66. 2019

  67. Diffraction patterns of amorphous materials as a series expansion of neighbor distribution functions, M. Micoulaut, Journal of Physics: condensed matter 31, 285402 (2019) pdf file.
  68.  
  69. Many-body effects at the origin of structural transitions in B2O3, A. Baroni, F. Pacaud, M. Salanne, M. Micoulaut, J.-M. Delaye, A. Zeidler, P.S. Salmon, G. Ferlat, J. Chem. Phys. 151, 224508 (2019) pdf file.
  70.  
  71. Signature of coordination defects in the vibrational spectrum of amorphous chalcogenides, M. Micoulaut, P. Boolchand, Frontiers in Materials 6, 283 (2019) pdf file.
  72.  
  73. Correlating Melt dynamics and Configurational Entropy change with Topological Phases of AsxS100-x glasses and the crucial role of melt-glass homogenization, S. Chakravarty, R. Chbeir, P. Chen, M. Micoulaut, Frontiers in Materials 6, 166 (2019) pdf file.
  74.  
  75. Evidence for a Correlation of Melt Fragility Index With Topological Phases of Multicomponent Glasses, R. Chbeir, M. Bauchy, M. Micoulaut and P. Boolchand, Frontiers in Materials 6, 173 (2019) pdf file.
  76.  
  77. Linking Melt dynamics with Topological Phases and molecular structure of Sodium Phosphate glasses from Calorimetry, Raman scattering and Infrared reflectance, C. Mohanty, A. Mandal, V. Gogi, P. Chen, D. Novita, R. Chbeir, M. Bauchy, M. Micoulaut, P. Boolchand, Frontiers in Materials 6, 69 (2019) pdf file.
  78.  
  79. Crystals at High Deformation Rates display Glassy Behavior, A. Rida, M. Micoulaut, A. Makke, E. Rouhaud, Physica Status Solidi B 256, 1800649 (2019) pdf file.
  80. 2018

  81. Glass relaxation and hysteresis of the glass transition by molecular dynamics simulations, Z. Liu, Y. Hu, X. Li, W. Song, S. Goyal, M. Micoulaut, M. Bauchy, Physical Review B 98, 104205 (2018) pdf file.
  82.  
  83. From elemental tellurium to Ge2Sb2Te5 melts: High temperature dynamic and relaxation properties in relationship with the possible fragile to strong transition, H. Flores-Ruiz, M. Micoulaut, Journal of Chemical Physics 148, 034502 (2018) pdf file.
  84.  
  85. Decoding entangled transitions : polyamorphism and stressed rigidity, C. Yildirim, J.-Y. Raty, M. Micoulaut, Journal of Chemical Physics 148, 244505 (2018) pdf file.
  86.  
  87. Structural, vibrational, and dynamic properties of Ge-Ga-Te liquids with increasing connectivity: A combined neutron scattering and molecular dynamics study, H. Flores-Ruiz, M. Micoulaut, A. Piarristeguy, M.-V. Coulet, M. Johnson, G.J. Cuello, A. Pradel, Physical Review B 97, 214207 (2018) pdf file.
  88.  
  89. The topological phases of chalcogenide glasses are encoded in the melt dynamics, P. Boolchand, M. Bauchy, M. Micoulaut, C. Yildirim, Physica Status Solidi B 255, 1800027 (2018) pdf file.
  90.  
  91. Kinetics of decelerated melting, L. Wondraczek, Z. Pan, T. Palenta, A. Erlebach, S.T. Misture, M. Sierka, M. Micoulaut, U. Hoppe, J. Deubener, G.N. Greaves, Advanced science 5, 1700850 (2018) pdf file.
  92. 2017

  93. Evidence for anomalous dynamic heterogeneities in isostatic supercooled liquids, M. Micoulaut, M. Bauchy, Physical Review Letters 118, 145502 (2017) pdf file.
  94.  
  95. Towards accurate models for amorphous GeTe: crucial effect of dispersive Van der Waals corrections on the structural properties involved in the phase change mechanism, M. Micoulaut, A. Piarristeguy, H. Flores-Ruiz, A. Pradel, Physical Review B 96, 184204 (2017) pdf file.
  96.  
  97. Structural properties of Ge-S amorphous networks in relationship with rigidity transitions: An ab initio molecular dynamics study, S. Chakraborty, P. Boolchand, M. Micoulaut, Physical Review B 96, 094205 (2017) pdf file.
  98.  
  99. Study of the effects of grain size on the mechanical properties of nanocrystalline copper using molecular dynamics simulation with initial realistic samples, A. Rida, E. Rouhaud, A. Makke, M. Micoulaut, B. Mantisi, Philosophical Magazine 97, 2387 (2017) pdf file.
  100.  
  101. Materials functionalities from molecular rigidity: Maxwell's modern legacy, M. Micoulaut, Y. Yue, Materials research Society Bulletin 42, 18 (2017) pdf file.
  102.  
  103. Shotvisual : a software to visualize shot dynamics, E. Guyot, E. Rouhaud, M. Micoulaut, Y. Colaitis, Proceedings of the International Conference on Shot Peening 13, 302 (2017).
  104.  
  105. Molecular dynamics investigations for surface mechanical attrition treatment, A.Rida, E. Rouhaud, M. Micoulaut, A. Makke, D. Retraint, Proceedings of the International Conference on Shot Peening 13, 322 (2017).

    2016

  106. Revealing the crucial role of molecular rigidity on the fragility evolution of glass-forming liquids, C. Yildirim, J.-Y. Raty, M. Micoulaut, Nature Communications 7, 11086 (2016) pdf file.
  107.  
  108. Universal amorphous-amorphous transition in GexSe1-x glasses under pressure, C. Yildirim, M. Micoulaut, P. Boolchand, I. Kantor, O. Mathon, J.-P. Gaspard, T. Irifune, J.-Y. Raty, Scientific Reports 6, 27317 (2016) pdf file.
  109.  
  110. Anomalous diffusion and non-monotonic relaxation processes in Ge-Se liquids C. Yildirim, J.-Y. Raty, M. Micoulaut, Journal of Chemical Physics 144, 224503 (2016) pdf file.
  111.  
  112. Concepts and applications of rigidity in non-crystalline solids: a review on new developments and new directions, M. Micoulaut, Advances in Physics X 1, 147 (2016) pdf file.
  113.  
  114. Relaxation and physical ageing in network glasses : a review, M. Micoulaut, Report on Progress in Physics 79, 066504 (2016) pdf file.
  115.  
  116. Premelting and cation mobility in simple silicates: contrasting the dynamics in the crystalline and supercooled state, B. Mantisi, M. Micoulaut, Journal of Non-Crystalline Solids 440, 1 (2016) pdf file.
  117.  
  118. How Visualization saves Money in R & D, M. Micoulaut, E. Rouhaud, E. Guyot, The Shot Peener Magazine 30, 36 (2016) pdf file.
  119. 2015

  120. Densified network glasses and liquids with thermodynamically reversible and structurally adaptive behavior, M. Bauchy, M. Micoulaut, Nature Communications 6, 6398 (2015) pdf file.
  121.  
  122. Effect of tellurium concentration on the structural and vibrational properties of phase change Ge-Sb-Te liquids, H. Flores-Ruiz, M. Micoulaut, M.V. Coulet, A. Piarristeguy, M.R. Johnson, G.J. Cuello, A. Pradel, Physical Review B 92, 134205 (2015) pdf file.
  123.  
  124. Liquid B2O3 up to 1700 K: x-ray diffraction and boroxol ring dissolution, O. Alderman, G. Ferlat, A. Baroni, M. Salanne, M. Micoulaut, C. Benmore, A. Lin, A. Tamalonis, J. Weber, Journal of Physics: Condensed Matter 27, 455104 (2005) pdf file.
  125.  
  126. Thermodynamic precursors, liquid-liquid transitions, dynamic and topological anomalies in densified liquid germania, F. Pacaud, M. Micoulaut, Journal of Chemical Physics 143 064502 (2015) pdf file.
  127.  
  128. Cycling through the glass transition: evidence for reversibility windows and dynamic anomalies, B. Mantisi, M. Bauchy, M. Micoulaut, Physical Review B 92, 134201 (2015) pdf file.
  129.  
  130. Structural singularities in GexTe100-x films, A. Piarristeguy, M. Micoulaut, R. Escalier, P. Jovari, I. Kaban, J. van Eijk, J. Luckas, S. Ravindren, P. Boolchand, A.Pradel, Journal of Chemical Physics 143, 074502 (2015) pdf file.
  131.  
  132. Topological constraints, rigidity transitions and anomalies in disordered molecular networks, M. Micoulaut, M. Bauchy, H. Flores-Ruiz, in Molecular Dynamics Simulations of Disordered Materials, i Springer Series in Materials Science 215, 275-311 (2015).

    2014

  133. Rigidity transitions in glasses driven by changes in network dimensionality and structural groupings, K. Vignarooban, P. Boolchand, M. Micoulaut, M. Malki, W. Bresser, EPL 108, 56001 (2014) pdf file.
  134.  
  135. Structural, dynamic, electronic and vibrational properties of flexible, intermediate and stressed rigid As-Se glasses and liquids from First Principles Molecular Dynamics simulations, M. Bauchy, A. Kachmar, M. Micoulaut, Journal of Chemical Physics 141, 194506 (2014) pdf file.
  136.  
  137. Structure and topology of soda-lime silicate glasses: implications for window glass, O. Laurent, B. Mantisi, M. Micoulaut, Journal of Physical Chemistry B 118, 12750 (2014) pdf file.
  138.  
  139. Quantitative measure of tetrahedral-sp3 geometries in amorphous phase change alloys, M. Micoulaut, K. Gunasekera, S. Ravindren, P. Boolchand, Physical Review B 90, 094207 (2014) pdf file.
  140.  
  141. Effect of mixed Ge/Si cross-linking on the physical properties of amorphous Ge-Si-Te networks, K. Gunasekera, P. Boolchand, M. Micoulaut, Journal of Applied Physics 115, 164905 (2014) pdf file.
  142.  
  143. Density-driven structural transformation in B2O3 glass, A. Zeidler, K. Wezka, D.A.J. Whittaker, P.S. Salmon, A. Baroni, S. Klotz, H.E. Fischer, M.C. Wilding, C.L. Bull, M.G. Tucker, M. Salanne, G. Ferlat, M. Micoulaut, Physical Review B 90, 024206 (2014) pdf file.
  144.  
  145. Effect of the composition on structure in liquid GexTe100-x: a combined density functional and neutron scattering study, M. Micoulaut, M.-V. Coulet, A. Piarristeguy, M.R. Johnson, G. Cuello, C. Bichara, J.-Y. Raty, H. Flores-Ruiz, A. Pradel, Physical Review B 89, 174205 (2014) pdf file.
  146.  
  147. Fragility and molar volumes of non-stoichiometric chalcogenides - the crucial role of melt/glass homogenization, R. Bagheria, K. Gunasekera, P. Boolchand, M. Micoulaut, Physica Status Solidi B 251, 1322 (2014) pdf file.
  148.  
  149. Crucial effect of glass processing and melt homogenization on the fragility of non-stoichiometric chalcogenides, S. Ravindren, K. Gunasekera, Z. Tucker, A. Diebold, P. Boolchand, M. Micoulaut, Journal of Chemical Physics 140, 134501 (2014) pdf file.
  150.  
  151. Designing heavy metal oxide glasses with threshold properties from network rigidity, S. Chakraborty, P. Boolchand, M. Malki, M. Micoulaut, Journal of Chemical Physics 140, 014503 (2014) pdf file.
  152.  
  153. CAD based model of ultrasonic shot peening for complex industrial parts, J. Badreddine, S. Remy, M. Micoulaut, E. Rouhaud, V. Desfontaine, P. Renaud, Advances in Engineering Software 76, 31 (2014) pdf file.
  154.  
  155. Simulation of shot dynamics for ultrasonic shot peening: effects of process parameters, J. Badreddine, E. Rouhaud, M. Micoulaut, S. Remy, International Journal of Mechanical Sciences 82, 179 (2014)
  156.  
  157. A model for ultrasonic shot peening: optimization of chamber design in an industrial context, J. Badreddine, M. Micoulaut, S. Remy, E. Rouhaud, P. Renaud, F. Chateau, V. Desfontaine, Proceedings of the 12th Internantional Conference on Shot Peening (2014) p. 370 pdf file.

    2013

  158. Percolative heterogeneous topological constraints and fragility in glass-forming liquids, M. Bauchy, M. Micoulaut, EPL 104, 56002 (2013) pdf file.
  159.  
  160. Structure, topology, rings, vibrational and electronic properties of GexSe1-x glasses across the rigidity transition: A numerical study M. Micoulaut, A. Kachmar, M. Bauchy, S. Le Roux, C. Massobrio, M. Boero, Physical Review B 88, 054203 (2013) pdf file.
  161.  
  162. The deep effect of topology on glass relaxation, M. Micoulaut, Physics 6, 72 (2013)
  163.  
  164. Elastic phases of GexSbxSe1-2x ternary glasses driven by topology, K. Gunasekera, P. Boolchand, M. Micoulaut, Journal of Physical Chemistry 117, 10027 (2013) pdf file.
  165.  
  166. Compositional thresholds and anomalies in connection with stiffness transitions in network glasses, M. Bauchy, M. Micoulaut, M. Boero, C. Massobrio, Physical Review Letters 110, 165501 (2013) pdf file.
  167.  
  168. Topology, super-strong melts and homogeneity of network glass forming liquids K. Gunasekara, S. Bhosle, P. Boolchand, M. Micoulaut, Journal of Chemical Physics 139, 164511 (2013) pdf file.
  169.  
  170. Van der Waals corrections for an improved structural description of telluride based materials, M. Micoulaut, Journal of Chemical Physics 138, 061103 (2013) pdf file.
  171.  
  172. Transport anomalies and adaptative pressure-dependent topological constraints in tetrahedral liquids : evidence for a reversibility window analogue, M. Bauchy, M. Micoulaut, Physical Review Letters 110, 095501 (2013) pdf file.
  173.  
  174. Structure of As2Se3 and As-Se network glasses : evidence for coordination defects and homopolar bonding M. Bauchy, M. Micoulaut, Journal of Non-Crystalline Solids 377, 34 (2013) pdf file.
  175.  
  176. Anomalies of the first sharp diffraction peak in network glasses : evidence for correlations with dynamic and rigidity properties, M. Micoulaut, M. Bauchy, Physica Status Solidi B 250, 976 (2013) pdf file.
  177.  
  178. Viscosity and viscosity anomalies in model silicates and magmas: a numerical investigation, M. Bauchy, B. Guillot, M. Micoulaut, N. Sator, Chemical Geology 346, 47 (2013) pdf file.
  179.  
  180. Effect of the confinement on the properties of vibrated granular gases, i J. Badreddine, M. Micoulaut, E. Rouhaud, S. Remy, D. Retraint, M. François, Granular Matter 15, 367 (2013) pdf file.
  181.  
  182. Modelling of Grain Refinement Induced by SMAT Process, Using a Complete Numerical Chaining Methodology, S. Benafia, D. Retraint, B. Panicaud, L. Le Joncour, E. Rouhaud, M. Micoulaut, Materials Science Forum 762, 295 (2013) pdf file.
  183.  
  184. 3D model of shot dynamics for ultrasonic shot peening, J. Badreddine, E. Rouhaud, M. Micoulaut, S. Remy, V. Desfontaine, P. Renaud, Materials Science Forum 768-769 503 (2013) pdf file.
  185.  
  186. Complete simulation of ultrasonic shot peening processes, J. Badreddine D. Gallitelli, E. Rouhaud, M. Micoulaut, S. Remy, M. François, V. Desfontaine, F. Chateau, P. Renaud, G. Doubre-Baboeuf, Surface Modfication Technologies XXVI, T.S. Sudarshan, M. Jeandin, V. Fridrici Eds. (2013) p. 11.
  187. 2012

  188. Tetrahedral germanium in amorphous phase change materials: exploring the isochemical scenario, M. Micoulaut, A. Kachmar, Th. Charpentier, Physica Status Solidi B 249, 1890-1896 (2012) pdf file. i
  189.  
  190. Sharply defined Intermediate phase in structurally homogeneous glasses, S. Bhosle, K. Gunasekera, P. Boolchand, M. Micoulaut, International Journal of Applied Glass Sience 3, 205 (2012) pdf file.
  191.  
  192. Synthesis and homogenization of GexSe100-x glasses, S. Bhosle, K. Gunasekera, P. Boolchand, M. Micoulaut, International Journal of Applied Glass Sience 3, 189 (2012) pdf file.
  193.  
  194. Investigation of size effects on the structure of liquid GeSe2 calculated via first-principles molecular dynamics, M. Micoulaut, S. Le Roux, C. Massobrio, Journal of Chemical Physics 136, 224504 (2012) pdf file.
  195.  
  196. CAD based simulation of ultrasonic shot peening processes, J. Badreddine, S. Remy, M. Micoulaut, E. Rouhaud, V. Desfontaine, F. Chateau, G. Doubre-Baboeuf, P. Renaud, i Proceedings of the International Design Conference - Design (2012) p. 373.
  197. 2011

  198. Meeting experimental challenges to physics of network glasses: assessing the role of sample homogeneity, S. Bhosle, P. Boolchand, M. Micoulaut, C. Massobrio, Solid State Communications 151 1851-1855 (2011) pdf file.
  199.  
  200. From pockets to channels: density controlled diffusion in silicates, M. Bauchy, M. Micoulaut, Physical Review B 83, 184118 (2011) pdf file.
  201.  
  202. Structure of liquid Ge2Se3: a first principles study, S. Le Roux, M. Boero, M. Micoulaut, A. Zeidler, P.S. Salmon, C. Massobrio, Physical Review B 83, 134203 (2011) pdf file.
  203.  
  204. Angular rigidity in tetrahedral network glasses with changing composition, M. Bauchy, M. Micoulaut, M. Celino, M. Boero, S. Le Roux, C. Massobrio, Physical Review B 83, 054201 (2011) pdf file.
  205.  
  206. Atomic scale foundation of temperature dependent constraints in glasses and liquids, M. Bauchy, M. Micoulaut, Journal of Non-Crystalline Solids 357, 2530 (2011) pdf file.
  207.  
  208. Structure and topology of phase change telluride melts, M. Micoulaut, C. Bichara, Journal of the Indian Institute of Sciences 91, 275 (2011) pdf file.
  209.  
  210. Maxwell rigidity and topological constraints in amorphous phase change networks, M. Micoulaut, C. Otjacques, J.-Y. Raty, C. Bichara, AIP Conference Proceedings 1393, International Conference on Advances in Condensed and Nanomaterials (2011) p. 38.
  211.  
  212. Impact distribution and velocity in ultrasonic shot peening, J. Badreddine, E. Rouhaud, M. Micoulaut, S. Remy, D. Retraint, M. François, Proceedings of the International Conference on Shot Peening 11, 99 (2011).
  213.  
  214. Simulation and experimental approach for shot velocity evaluation in ultrasonic shot peening, J. Badreddine, E. Rouhaud, M. Micoulaut, D. Retraint, S. Remy, M. François, P. Viot, G. Doubre-Baboeuf, D. Le Saunier, V. Desfontaines, Mécanique & Industries 12, 223 (2011) pdf file.
  215. 2010

  216. Direct evidence of a characteristic lengthscale of a dynamical nature in the Boolchand phase of glasses, M. Micoulaut, M. Malki, Physical Review Letters 105, 235504 (2010) pdf file.
  217.  
  218. Linking rigidity with enthalpic changes at the glass transition and the fragility of glass-forming liquids: insight from a simple oscillator model, M. Micoulaut, Journal of Physics: Condensed Matter 22, 285101 (2010) pdf file.
  219.  
  220. Understanding phase-change materials from the viewpoint of Maxwell rigidity, M. Micoulaut, C. Otjacques, J-Y. Raty, C. Bichara, Physical Review B 81, 174206 (2010) pdf file.
  221.  
  222. Impact of the exchange-correlation functional on the structure of glassy GeSe2, C. Massobrio, M. Micoulaut, P.S. Salmon, Solid State Sciences 12, 199 (2010) pdf file.

    2009

  223. Fast ion conduction and flexibility and rigidity of solid electrolyte glasses, M. Micoulaut, M. Malki, D.I. Novita, P. Boolchand, Physical Review B 80, 184205 (2009) pdf file.
  224.  
  225. Elastic flexibility, fast-ion conduction, boson and floppy modes in AgPO3-AgI glasses, D.I. Novita, P. Boolchand, M. Malki, M. Micoulaut, Journal of Physics: Condensed Matter 21, 205106 (2009) pdf file.
  226.  
  227. Improved short- and intermediate-range structure of liquid GeSe2: the role of the exchange-correlation functional, M. Micoulaut, R. Vuilleumier, C. Massobrio, Physical Review B 79, 214204 (2009)i pdf file.
  228.  
  229. Atomic structure of the two intermediate phase glasses SiSe4 and GeSe4, C. Massobrio, M. Celino, P.S. Salmon, R.A. Martin, M. Micoulaut, A. Pasquarello, Physical Review B 79, 174201 (2009) pdf file.
  230.  
  231. Molar volume minimum and adaptative rigid networks in relationship with the intermediate phase in glasses, C. Bourgel, M. Micoulaut, M. Malki, P. Simon, Physical Review B 79, 024201 (2009) pdf file.
  232.  
  233. Improving the structural description of high-temperature liquid GeSe2 from ab initio Molecular Dynamics simulations, M. Micoulaut, C. Massobrio, Journal of Optoelectronics and Advanced Materials 12, 1897 (2009) pdf file..
  234.  
  235. First-Principles simulations of liquid and vitreous B2S3, G. Ferlat, M. Micoulaut, European Journal of Glass Science and Technology 50, 284 (2009) pdf file.
  236.  
  237. Bonding defects and bonding strength in liquid and amorphous SnSe2, M. Micoulaut, Proceedings of the European Phase Change and Ovonics Symposium (2009) p. 112 pdf file.
  238.  
  239. Effect of rigidity and flexibility on electrical transport in network glasses, M. Malki, M. Micoulaut, D. I. Novita, B. Goodmann, P. Boolchand, Rigidity and Intermediate Phases in Nanomaterials, Eds. M. Micoulaut, M. Popescu, INOE Publishing House (2009) p. 37.
  240.  
  241. Topological frameworks for rigidity transitions and the intermediate phase, M. Micoulaut, Rigidity and Intermediate Phases in Nanomaterials, Eds. M. Micoulaut, M. Popescu, INOE Publishing House (2009) p. 129.
  242. 2008

  243. Intermediate Phase, network demixing, boson and floppy modes, and compositional trends in glass transition temperature of binary AsxS1-x system, P. Chen, C. Holbrook, P. Boolchand, D.G. Georgiev, M. Micoulaut, Physical Review B 78, 224208 (2008) pdf file.
  244.  
  245. Structure of the liquid and the crystal of the phase-change material SnSe2w/sub>: First-Principles Molecular Dynamics, M. Micoulaut, W. Welnic, M. Wuttig, Physical Review B 78, 224209 (2008) pdf file.
  246.  
  247. Constrained interactions, rigidity, adaptative networks and their role for the description of silicates, M. Micoulaut, American Mineralogist 93, 1732 (2008) pdf file.
  248.  
  249. Abrupt boundaries of intermediate phases and space filling in oxide glasses, R. Rompicharla, D.I. Novita, P. Chen, P. Boolchand, M. Micoulaut, W. Huff, Journal of Physics: Condensed Matter 20, 202101 (2008) pdf file.
  250.  
  251. Nature of glass transition, P. Boolchand, M. Micoulaut, P. Cheng, Phase Change Materials: Science and Applications, Eds. S. Raoux, M. Wuttig, Springer Verlag (2008) p.37.
  252. 2007

  253. Fast ion-conduction and flexibility of glassy networks, D. Novita, P. Boolchand, M. Malki, M. Micoulaut, Physical Review Letters 98, 195501 (2007) pdf file. i
  254.  
  255. Onset of rigidity in glasses: from random to self-organized networks, M. Micoulaut, J.C. Phillips, Journal of Non-Crystalline Solids 353, 1732 (2007) pdf file.
  256.  
  257. Chemical alloying and light-induced collapse of self-organization in network glasses, F. Wang, P. Boolchand, K. Jackson, M. Micoulaut, Journal of Physics: Condensed Matter 19, 226201 (2007) pdf file.
  258.  
  259. Coordination and intermediate range order alterations in densified germania, M. Micoulaut, X. Yuan, L.W. Hobbs, Journal of Non-Crystalline Solids 353, 1961 (2007) pdf file.
  260.  
  261. Granular gases in mechanical engineering: on the origin of heterogeneous ultrasonic shot peening, M. Micoulaut, S. Mechkov, D. Retraint, P. Viot, M. François, Granular Matter 9, 25 (2007) pdf file.
  262.  
  263. Simple clues and rules for self-organized rigidity in chalcogenide networks, M. Micoulaut, Journal of Optoelectronics and Advanced Materials 10, 3235 (2007) pdf file.
  264. 2006

  265. The structure of amorphous, crystalline and liquid GeO2, M. Micoulaut, L. Cormier, G.S. Henderson, Journal of Physics: Condensed Matter 18, R753 (2006) pdf file.
  266.  
  267. Intermediate phases in glasses driven by speciation, M. Micoulaut, Physical Review B 74, 184208 (2006) pdf file.
  268.  
  269. Correlation between floppy to rigid transitions and non-Arrhenius conductivity in glasses, M. Malki, M. Micoulaut, F. Chaimbault, Y. Vaills, Physical Review Letters 96, 145504 (2006) pdf file.
  270.  
  271. Simulated structural and thermal properties of glassy and liquid germania, M. Micoulaut, Y. Guissani, B. Guillot, Physical Review E 73, 031504 (2006) pdf file.
  272. 2005

  273. Raman threshold and rigid to floppy transitions in calcium silicate glasses, M. Micoulaut, M. Malki, P. Simon, A. Canizares, Philosophical Magazine 85, 3357 (2005) pdf file. i
  274.  
  275. Direct evidence of rigidity loss and self-organization in silicates, Y. Vaills, T. Qu, M. Micoulaut, F. Chaimbault, P. Boolchand, Journal of Physics: Condensed Matter 17, 4889-4896 (2005) pdf file.
  276.  
  277. Aging, fragility and reversibility window in bulk alloy glasses, S. Chakravarty, D.G. Georgiev, P. Boolchand, M. Micoulaut, Journal of Physics. Condensed Matter 17, L1 (2005) pdf file.
  278.  
  279. Verres en transitions, gaz granulaires en génie mécanique, M. Micoulaut, Mémoire d'Habilitation à Diriger des Recherches, Université VI (2005).
  280.  
  281. Heterogeneous ultrasonic shot peening: experiment and simulation, M. Micoulaut, D. Retraint, P. Viot, M. François, Proceedings of the International Conference on Shot Peening 9, 119 (2005) pdf file.
  282.  
  283. Grenaillage ultrasonore hétérogene, M. Micoulaut, D. Retraint, P. Viot, M. Francois, Actes du 17è CongrèFrancais de Ménique, 689(1- (2005)
  284. 2004

  285. A comparative numerical study of liquid GeO>sub>2 and SiO2, M. Micoulaut, Chemical Geology 213, 197 (2004) pdf file.
  286.  
  287. Structure of densified amorphous germanium dioxide, M. Micoulaut, Journal of Physics: Condensed Matter 16, L131 (2004) pdf file.
  288. 2003

  289. Comment on Microscopic theory of network glasses, M. Micoulaut, P. Boolchand, Physical Review Letters 91, 159601 (2003) pdf file.
  290.  
  291. Percolative conductivity in alkali earth oxide glasses, M. Malki, M. Micoulaut, F. Chaimbault, Y. Vaills, P. Simon, Europhysics Letters 64, 661 (2003) pdf file.
  292.  
  293. Ring statistics and rigidity transitions in network glasses, M. Micoulaut, J.C. Phillips, Physical Review B 67, 104204 (2003) pdf file.
  294.  
  295. The self-organized phase of bulk PxSe1-x glasses, D.G. Georgiev, P. Boolchand, H. Eckert, M. Micoulaut, K. Jackson, Europhysics Letters 62, 49 (2003) pdf file.
  296.  
  297. The intermediate phase in ternary GexAsxSe1-2x glasses, T. Qu, D.G. Georgiev, P. Boolchand, M. Micoulaut, in Supercooled Liquids, Glass Transition and Bulk Metallic Glasses Ed. T. Egami, A. L. Greer, A. Inoue, S. Ranganathan, Materials Research Society Symposium Proceedings 754, (2003) CC8.1.1 pdf file
  298. 2002

  299. Network entropy and energy: the underlying factors determining compositional trends in the glass transition temperature, M. Micoulaut, Comptes-Rendus Chimie 5, 825 (2002) pdf file.
  300.  
  301. Rigidity transitions and constraint counting in amorphous networks: beyond the mean-field approach, M. Micoulaut, Europhysics Letters 58, 830 (2002) pdf file.
  302.  
  303. Intermediate phase in molecular networks and solid electrolytes, M. Micoulaut, Journal of Superconductivity: Incorporating Novel Magnetism 15, 627 (2002) pdf file.
  304.  
  305. Nature of the glass transition in chalcogenides, D.G. Georgiev, P. Boolchand, M. Micoulaut, Festschrift pour S. Ovshinsky, Journal of Optoelectronics and Advanced Materials 4, 823 (2002) pdf file.
  306.  
  307. Percolation de rigidité et détection de contraintes résiduelles dans les verres, M. Micoulaut, F. Chaimbault, Y. Vaills, Actes du colloque Caractérisation expérimentale des contraintes: techniques avancées et nouveaux matériaux, UTT-Troyes (2002) p. 108.
  308.  
  309. On the central role of local structure in determining the glass transition temperature in network materials, M. Micoulaut, G.G. Naumis, Recent Research Developments in Non-crystalline Solids, Ed. S.G. Pandalai, Transworld Research Network 2, 363 (2002).
  310. 2001

  311. A sharp rigid to floppy phase transition induced by dangling ends in a network glass, Y. Wang, J. Wells, D.G. Georgiev, P. Boolchand, K. Jackson, M. Micoulaut, Physical Review Letters 87, 185503 (2001) pdf file.
  312.  
  313. Molecular structure, glass transition temperature variation, agglomeration theory and network connectivity of binary P-Se glasses, D.G. Georgiev, M. Mitkova, P. Boolchand, G. Brunklaus, H. Eckert, M. Micoulaut, Physical Review B 64, 134204 (2001) pdf file.
  314.  
  315. Glass transition temperature variation as a probe for network connectivity, M. Micoulaut, Phase Transitions and Self-Organization in Electronic and Molecular Networks, J.C. Phillips, M.F. Thorpe Eds., Kluwer Academic/Plenum Press (2001) p. 143
  316. 2000

  317. Glass structure, rigidity transitions and the intermediate phase in the Ge-As-Se ternary, Y. Wang, P. Boolchand, M. Micoulaut, Europhysics Letters 52, 633 (2000) pdf file.
  318.  
  319. Rigidity Transitions and Molecular Structure of AsxSe1-x glasses, D.G. Georgiev, P. Boolchand, M. Micoulaut, Physical Review B 62, 9228 (2000) pdf file.
  320. 1999

  321. Glass transition temperature variation, cross-linking and structure in network glasses: A stochastic approach, M. Micoulaut, G.G. Naumis, Europhysics Letters 47, 568 (1999) pdf file.
  322.  
  323. Solvable models of glass transition, M. Micoulaut, Proceedings de l'Ecole de Cargèse Physics of glasses: structure and dynamics, Ph. Jund, R. Jullien Eds., American Institute of Physics 480, 253 (1999)
  324. 1998

  325. Nucleation model for the description of glass formation, M. Micoulaut, Modern Physics Letters B 12, 561 (1998)
  326.  
  327. The slope equations: a universal relationship between local structure and glass transition temperature, M. Micoulaut, The European Physical Journal B 1, 277 (1998) pdf file.
  328.  
  329. Local structure and glass transition temperature in binary glasses, M. Micoulaut, Journal of Non-Crystalline Solids 232-234, 567 (1998) pdf file.
  330.  
  331. Boroxol rings and the stochastic matrix method, G.G. Naumis, R. Kerner, M. Micoulaut, R.A. Barrio, Proceedings XXVII RI Fisica Estadistica, Cuernavaca, Mexico, Revista Mexicana de Fisica 44, 40 (1998).
  332. 1997

  333. Evaluation of the concentration of boroxol rings in vitreous B2O3 by the stochastic matrix method, R.A. Barrio, R. Kerner, M. Micoulaut, G.G. Naumis, Journal of Physics: Condensed Matter 9, 9219 (1997) pdf file.
  334.  
  335. A model of glass transition in binary and ternary glasses, R. Kerner, M. Micoulaut, Journal of Molecular Liquids 71, 175 (1997) pdf file.
  336.  
  337. Structure of vitreous B2O3 obtained with a thermostatistical model of agglomeration, M. Micoulaut, Journal of Molecular Liquids 71, 107 (1997) pdf file.
  338.  
  339. On the glass transition in covalent networks, R. Kerner, M. Micoulaut, Journal of Non-Crystalline Solids 210, 298 (1997) pdf file.
  340.  
  341. Structure of lithium silicon sulphide glass systems, M. Micoulaut, R. Kerner, Journal of Physics: Condensed Matter 9, 2551 (1997) pdf file.
  342.  
  343. Statistics of rings in glass networks, M. Micoulaut, Current Problems in Condensed Matter, Theory and Experiment, J.L Moran-Lopez Ed., Plenum Press (1998), p. 339.
  344. 1992-1996

  345. A simple dynamical model for the description of binary glass-forming systems, M. Micoulaut, Physica B 226, 268-282 (1996) pdf file.
  346.  
  347. Statistical modelling of structural and thermodynamical properties of vitreous B2O3, M. Micoulaut, R. Kerner, D.M. dos Santos-Loff, Journal of Physics: Condensed Matter 7, 8035 (1995) pdf file.
  348.  
  349. Structure of SiSe2 based glasses, M. Micoulaut, Physica B 212, 43 (1995) pdf file.
  350.  
  351. Statistics of boroxol rings in vitreous boron oxide, D.M. dos Santos-Loff, M. Micoulaut, R. Kerner, Europhysics Letters 28, 573 (1994) pdf file.
  352.  
  353. A theoretical model of covalent binary glasses II: Structure of B2S3-nLi2S systems, M. Micoulaut, R. Kerner, Journal of Non-Crystalline Solids 176, 280 (1994) pdf file.
  354.  
  355. A theoretical model of covalent binary glasses I: Structure of B2S3-nLi2S systems, R.Kerner, M. Micoulaut, Journal of Non-Crystalline Solids 176, 271 (1994) pdf file.
  356.  
  357. Structure des verres SiS2-Li2S obtenue par un modèle statistique d'agglométion, M. Micoulaut, Comptes Rendus de l'Académie des Sciences Paris 316, Série II, 1679 (1993) pdf file.
  358.  
  359. Influence du refroidissement sur un processus d'agglomération moléculaire, R. Kerner, M. Micoulaut, Co Comptes Rendus de l'Académie des Sciences Paris 315, Série II, 1307 (1992) pdf file.
  360.  
  361. Modélisation et étude de verres binaires covalents, M. Micoulaut, Thèse de Doctorat d'Université Paris VI, Novembre 1993.