All Stories

  1. An integrated Petri net-pseudo bond graph model for nuclear hazard assessment
  2. Thermodynamics up to the melting point in a TaVCrW high entropy alloy: Systematic ab in...
  3. A ReaxFF potential for Al–ZnO systems
  4. Author Correction: Chlorine activated stacking fault removal mechanism in thin film CdTe solar cells: the missing piece
  5. Atomistic simulation of helium diffusion and clustering in plutonium dioxide
  6. Low-E Glass Improvement by the Understanding and Control of the Ag Growth
  7. Chlorine activated stacking fault removal mechanism in thin film CdTe solar cells: the missing piece
  8. Chlorine activated stacking fault removal mechanism in thin film CdTe solar cells: the whole story
  9. Chlorine passivation of grain boundaries in cadmium telluride solar cells
  10. Deformation and dewetting of liquid films under gas jets
  11. Thickness-dependent surface energy and formation of epitaxial quantum dots
  12. Inert gas bubble formation in magnetron sputtered thin-film CdTe solar cells
  13. Enhancement of photovoltaic efficiency in CdSe x Te1−x (where 0 ⩽ x ⩽ 1): insights from density functional theory
  14. Modelling defect evolution in irradiated graphite
  15. Inert gas cluster formation in sputter-deposited thin film CdTe solar cells
  16. Modelling the effect of hydrogen on crack growth in zirconium
  17. Modelling thin film growth in the Ag–Ti system
  18. Near-surface structure and residual stress in as-machined synthetic graphite
  19. Mesoscopic structure features in synthetic graphite
  20. Growth of silver on zinc oxide via lattice and off-lattice adaptive kinetic Monte Carlo
  21. Reaction pathways in atomistic models of thin film growth
  22. Iron phosphate glasses: Bulk properties and atomic scale structure
  23. Modelling the evaporation of nanoparticle suspensions from heterogeneous surfaces
  24. NdFeO3nanocrystals under glycine nitrate combustion formation
  25. Interfacial surface roughness determination by coherence scanning interferometry using noise compensation
  26. Measurement of thin film interfacial surface roughness by coherence scanning interferometry
  27. A ReaXFF carbon potential for radiation damage studies
  28. A new potential for radiation studies of borosilicate glass
  29. Critical island size for Ag thin film growth on ZnO (0 0 01¯)
  30. Development of an empirical interatomic potential for the Ag–Ti system
  31. Fröhlich resonance in carbon nanospiroids and the 2175 Å interstellar absorption feature
  32. Inter-atomic potentials for radiation damage studies in CePO 4 monazite
  33. Thermal dynamics of silver clusters grown on rippled silica surfaces
  34. Radiation tolerance of iron phosphate: A study of amorphous and crystalline structures
  35. Sub-monolayer growth of Ag on flat and nanorippled SiO2surfaces
  36. Refractive index determination by coherence scanning interferometry
  37. Iron phosphate glasses: Structure determination and radiation tolerance
  38. An interpretation of the strongest X-ray diffraction peak for various carbon nanoclusters
  39. Inert gas bubbles in bcc Fe
  40. The development of thin film metrology by coherence scanning interferometry
  41. Opposite correlations between cation disordering and amorphization resistance in spinels versus pyrochlores
  42. Helium bubbles in bcc Fe and their interactions with irradiation
  43. Borosilicate glass potentials for radiation damage simulations
  44. Ripple structures on ion bombarded surfaces arising from the sputter yield dependence on incidence angle
  45. Iron phosphate glasses: Structure determination and displacement energy thresholds, using a fixed charge potential model
  46. Prediction of Irradiation Spectrum Effects in Pyrochlores
  47. Influence of the prefactor to defect motion inα-Iron during long time scale simulations
  48. He migration and bubble formation in Ga stabilised δ-Pu
  49. Structure-induced negatively skewed X-ray diffraction pattern of carbon onions
  50. Simulating radiation damage in a bcc Fe system with embedded yttria nanoparticles
  51. A travelling wave model of ripple formation on ion bombarded surfaces
  52. Sputtering of Au surfaces at realistic dose rates using molecular dynamics and on-the-fly kinetic Monte Carlo
  53. Modelling the growth of ZnO thin films by PVD methods and the effects of post-annealing
  54. Variable step radial ordering in carbon onions
  55. Ion beam induced surface pattern formation and stable travelling wave solutions
  56. Helium Bubbles in Fe: Equilibrium Configurations and Modification by Radiation
  57. Modelling the sputtering of Au surfaces using a multi time-scale technique
  58. Statistical analysis of interatomic bonds and interlayer distances in a carbon helical onion structure with a variable step
  59. Modeling evaporation, ion-beam assist, and magnetron sputtering of thin metal films over realistic time scales
  60. Atomistic modelling of titania grown using PVD methods
  61. Point defect formation and migration in Ga stabilised δ-Pu
  62. Modeling evaporation, ion-beam assist, and magnetron sputtering of TiO2 thin films over realistic timescales
  63. Atomistic surface erosion and thin film growth modelled over realistic time scales
  64. Simulating radiation damage in Ga stabilised δ-Pu
  65. Markov-chain model of classified atomistic transition states for discrete kinetic Monte Carlo simulations
  66. Modelling radiation damage effects on a bcc iron lattice containing phosphorous impurity atoms near symmetrical tilt boundaries
  67. Long time scale evolution of radiation-induced defects in
  68. Surface topography induced by swift heavy ion impacts
  69. Ordered Ag nanocluster structures by vapor deposition on pre-patterned SiO2
  70. Growth mechanisms forTiO2at its rutile (110) surface
  71. Modeling the Sputter Deposition of Thin Film Photovoltaics using Long Time Scale Dynamics Techniques
  72. Surface Erosion of TiO2 subjected to Energetic Oxygen Bombardment
  73. Displacement threshold and Frenkel pair formation energy in ionic systems
  74. Growth of TiO2 surfaces following low energy (<40eV) atom and small cluster bombardment
  75. Radiation effects at the HfO2–MgO interface
  76. Evolution of diamond nanoclusters in the interstellar medium
  77. Non-stoichiometry in MgAl2O4spinel
  78. Surface and interstitial transition barriers in rutile (110) surface growth
  79. Atomistic-scale modelling of nanoindentation into optical coatings
  80. Surface topography after single particle and cluster impacts on gold surfaces
  81. Modelling of deposition processes on the TiO2 rutile (110) surface
  82. Simulating radiation damage in δ-plutonium
  83. A theoretical study of intrinsic point defects and defect clusters in magnesium aluminate spinel
  84. NANODIAMONDS ENVELOPED IN GLASSY CARBON SHELLS AND THE ORIGIN OF THE 2175 Å OPTICAL EXTINCTION FEATURE
  85. The contribution of carbon nanoparticles to the interstellar optical extinction
  86. Radiation damage and evolution of radiation-induced defects in Er2O3bixbyite
  87. Hot stage nanoindentation in multi-component Al–Ni–Si alloys: Experiment and simulation
  88. Nanoindentation and nanoscratching of rutile and anatase TiO2studied using molecular dynamics simulations
  89. Friction at the nanoscale
  90. Silicon potentials investigated using density functional theory fitted neural networks
  91. Atomistic simulations of radiation induced defect formation in the Er2O3 sesquioxide
  92. Investigation of Nanoscratch Processes in Semiconductor Materials for Application to Maskless Patterning
  93. Radiation defect formation in graded-band-gap epitaxial structures Hg1−xCdxTe after boron ion implantation
  94. Structure and mobility of radiation-induced defects in MgO
  95. Ab initiostudy of point defects in magnesium oxide
  96. Defect kinetics in spinels: Long-time simulations ofMgAl2O4,MgGa2O4, andMgIn2O4
  97. A new approach to potential fitting using neural networks
  98. Ab-initio modelling of defects in MgO
  99. Chapter 15 Modelling the structure and dynamics of metal nanoclusters deposited on graphite
  100. Improved grid-based algorithm for Bader charge allocation
  101. Atomistic simulations of radiation-induced defect formation in spinels:MgAl2O4,MgGa2O4, andMgIn2O4
  102. Risk modelling of fires and explosions in open-sided offshore platform modules
  103. The structure of atomic and molecular clusters, optimised using classical potentials
  104. Molecular dynamics modelling of radiation damage in normal, partly inverse and inverse spinels
  105. Simulations of cascades in pure and alumina doped magnesia
  106. Multi-cycling nanoindentation in MgO single crystals before and after ion irradiation
  107. Mechanical properties of superhard materials synthesised at various pressure–temperature conditions investigated by nanoindentation
  108. Modeling the pinning of Au and Ni clusters on graphite
  109. Atomistic modelling of ploughing friction in silver, iron and silicon
  110. Diffusion dynamics of defects in Fe and Fe-P systems
  111. Molecular dynamics simulations of nanoindentation and nanotribology
  112. Stick slip and wear on metal surfaces
  113. Density functional study of Aun (n=3–5) clusters on relaxed graphite surfaces
  114. The influence of P solutes on an irradiated α-Fe matrix
  115. A model for the prediction of radiation defect profiles in the semiconductor target (HgCdTe) subjected to high power short pulsed ion beams
  116. A molecular dynamics model for the Coulomb explosion
  117. Diffusion of radiation damage in Fe–P systems
  118. The interaction of P atoms and radiation defects with grain boundaries in an α-Fe matrix
  119. Gold adatoms and dimers on relaxed graphite surfaces
  120. Modeling of stick-slip phenomena using molecular dynamics
  121. Atomistic simulations of structural transformations of silicon surfaces under nanoindentation
  122. Molecular-dynamics simulations of sputtering
  123. Spatial distribution profiles of defects in mercury cadmium telluride after ion implantation
  124. Molecular dynamic simulations of nanoscratching of silver (100)
  125. Nanostructured surfaces described by atomistic simulation methods
  126. Interaction of silver adatoms and dimers with graphite surfaces
  127. Computer modelling of ballistic particle ejection from NaCl
  128. Nanoscratching of silver () with a diamond tip
  129. The bonding sites and structure of C60 on the Si() surface
  130. Scaling behavior of the penetration depth of energetic silver clusters in graphite
  131. Implantation depth of size-selected silver clusters into graphite
  132. The structure of C60 and endohedral C60 on the Si{100} surface
  133. Atomistic modelling of nanoindentation in iron and silver
  134. The structure and energetics of carbon-nitrogen clusters
  135. Preferential damage at symmetrical tilt grain boundaries in bcc iron
  136. Biofilms and their modifications by laser irradiation
  137. Growth of amorphous carbon films by carbon atom bombardment in the energy range 10–500 eV
  138. Nanoindentation of carbon materials
  139. Numerical calculations using the hyper-molecular dynamics simulation method
  140. Numerical implementation of the hyper-molecular dynamics method with examples applied to diffusion
  141. Low energy deposition of size-selected Si clusters onto graphite
  142. Pinning of size-selected Ag clusters on graphite surfaces
  143. Diffusion limited biofilm growth
  144. Structural changes at grain boundaries in bcc iron induced by atomic collisions
  145. Nanoindentation of diamond, graphite and fullerene films
  146. Shallow junction formation by decaborane molecular ion implantation
  147. Theoretical study of electronic energy loss recently observed in impact collision ion scattering of a low energy Li+ from a TaB2(0001) surface
  148. Applications of genetic algorithms and neural networks to interatomic potentials
  149. Electronic energy loss of slow projectiles evaluated by molecular orbital theory
  150. Modelling radiation effects at grain boundaries in bcc iron
  151. Applications of neural networks to fitting interatomic potential functions
  152. Empirical potentials for C[sbnd]Si[sbnd]H systems with application to C60interactions with Si crystal surfaces
  153. Surface growth modes analysed with modern microscopic and computing techniques
  154. Molecular dynamics studies of particle impacts with carbon-based materials
  155. C60 film growth and the interaction of fullerenes with bare and H terminated Si surfaces, studied by molecular dynamics
  156. A molecular dynamics study of energetic particle impacts on carbon and silicon
  157. An investigation of collision propagation in energetic ion initiated cascades in copper
  158. Ion bombardment of polyethylene
  159. Molecular dynamics simulations of particle-surface interactions
  160. The interaction of C60 with hydrogen plasma
  161. Early stages of bump formation on the surface of ion-bombarded graphite
  162. The interaction of hydrogen with C60fullerenes
  163. Atomic collisions in semiconductors
  164. Ballistic simulation in surface science
  165. Energetic fullerene interactions with Si crystal surfaces
  166. Fast formulae for the time integral in binary collision calculations
  167. The structure of small clusters ejected by ion bombardment of solids
  168. Trapping mechanisms in scattering of beams at grazing incidence from crystals
  169. A semi-empirical many-body interatomic potential for modelling dynamical processes in gallium arsenide
  170. Computational models in atomic collision studies
  171. Long-range channelling in low energy ion implantation into silicon
  172. A single crystal carbon self-sputtering simulation
  173. High-yield sputtering events forAr+
  174. keV particle bombardment of semiconductors: A molecular-dynamics simulation
  175. The evolution of gradient discontinuities (edges) on sputter-eroded surfaces
  176. Precision modeling of the mask–substrate evolution during ion etching
  177. Optimisation of the properties of a microfocused ion beam system
  178. Analytic, geometric and computer techniques for the prediction of morphology evolution of solid surfaces from multiple processes
  179. The criteria for surface reproducibility during erosion or growth
  180. High accuracy ion optics computing
  181. An algorithm to calculate secondary sputtering by the reflection of ions in two dimensions
  182. The development of surface discontinuities (edges) during sputtering induced erosion of solids
  183. Erosion of corners and edges on an ion-bombarded silicon surface
  184. Sample rocking and rotation in ion beam etching
  185. Surface topography evolution resulting from reactive etching and codeposition processes
  186. Computational models of liquid metal ion sources
  187. Surface morphology of Si(100), GaAs(100) and InP(100) following O2+ and Cs+ ion bombardment
  188. Sputter-depth profiling in AES: Dependence of depth resolution on electron and ion beam geometry
  189. Surface morphology during ion etching The influence of redeposition
  190. Surface morphology during ion etching The influence of redeposition
  191. The development of surface topography using two ion beams
  192. The erosion of amorphous and crystalline surfaces by ion bombardment
  193. The development of a general three‐dimensional surface under ion bombardment
  194. The development of surface shape during sputter-depth profiling in Auger electron spectroscopy
  195. The shape of field-ion emitters
  196. Ring counting in field-ion micrographs
  197. Ion trajectories in the field-ion microscope
  198. The distortion of a non-aligned magnetic field by the flow of an inviscid conducting fluid past a circular cylinder