Multifunctional Materials and Modeling

This important book presents a valuable collection of new research and new trends in nanomaterials, mesoscopy, quantum chemistry, and chemical physics processes. It highlights the development of nanomaterials as well as investigation of combustion and explosion processes. It highlights new trends in processes and methods of the treatment of polymeric materials and also covers material modification, including super small quantities of metal/carbon nanocomposites as well as new information on the modeling of processes and quantum calculations. Nonlinear kinetic appearances and their applications are highlighted as well. The chapters are divided into three major sections: computational modeling, surface and interface investigations, and nanochemistry, nanomaterials, and nanostructured materials. Content: PrefaceThe Calculations of the Complex of the Red Mercuric Iodide Fundamental Optical Functions D. V. Anisimov, V. V. Sobolev, and V. Val. SobolevExperimental Research of Grassy Rags Ignition by Heated Up to High Temperatures Carbon Particle N. V. Baranovskiy and A. V. ZakharevichSimulation of Structural Transformations of Spring Steel During the Quenching Process B. Ya. Benderskiy and K. A. KopylovInfluence of Electron Beam Parameters on Ignition of Energetic Materials G. A. Ivanov and A. V. KhaneftComputer Simulating of Solid Solution AgxPb1 XS 1 Hydrochemical Deposition Process A. Y. Kirsanov, V. F. Markov, and L. N. MaskaevaKinetics of Molecular Desorption in a Spherical Nanopore M. G. Kucherenko, T. M. Chmereva, A. D. Dmitriev, and D. V. StrugovaCalculating Gas Flow in Polybutadiene Pores During Pyrolysis A. M. Lipanov and A. A. BolkisevPostcascade Shock Waves Influence on Vacancy Pores Structural Transformations A. V. Markidonov, M. D. Starostenkov, E. P. PavlovskayaOccurrence of Acoustic Instability in Hydrogen-Air Mixtures in the Closed Reactor at the Central Spark Initiation I. M. Naboko, N. M. Rubtsov, B. S. Seplyarsky, V. I. Chernysh, and G. I. TsvetkovElectronic Structure of Plumbum Selenide N. I. Petrova, A. I. Kalugin, and V. V. SobolevSimulation of Pollutants Generation in the Combustion Chamber of the Gas Turbine Power Plant E. V. Safonov and M. A. KorepanovThe Exciton Spectra of Strontium Sulfide V. V. Sobolev, V. Val. Sobolev, and D. A.MerzlyakovSimulation of the Interaction of Fullerene and Iron Fe (100) A. V. Vakhrushev, S. V. Suvorov, and A. V. SeveryukhinFormation, Optical and Electrical Properties of Ca3si4 Films and Si/Ca3Si4/Si(111) Double Heterostructures N. G. Galkin, D. A. Bezbabnyi, K. N. Galkin, S. A. Dotsenko, I. M. Chernev, and A. V. VakhrushevStructural and Chemical Transformations of the Mechanoactivated Calcium Lactate in Vortex Mill O. . Kanunnikova S. S. Mikhailova, V. V. Muhgalin, V. V. Aksenova, F. Z. Gilmutdinov, and V. I. LadyanovNonmonotonic Change of the Composition of Surface Layers of the Melt Co57 Ni10Fe5Si11B17 During Isothermal Process A. V. Kholzakov and A. G. PonomarevNickel(Ii) and Ethylenediaminetetraacetate Acid Interreaction in Water Solution of Aminopropionic Acid V. I. Kornev and N. S. BuldakovaEffect of Magnetic Field and UV Radiation on Structural State and Biological Properties of Oleic Acid and Olive Oil V. I. Kozhevnikov, O. M. Kanunnikova, S. S. Mikhailova, S. S. Makarov, and V. B. DementyevMetastable Interstitial Phases by Ball Milling of Titanium in Liquid Hydrocarbons A. N. Lubnin, G. A. Dorofeev, V. I. Lad'yanov, V. V. Mukhgalin, O. M. Kanunnikova, S. S. Mikhailova, and V. V. AksenovaParameters of Mobility for Pollution by Sodium Arsenite for Soil of Kambarka District V. G. Petrov, M. A. Shumilova, and O. S. NabokovaX-Ray Photoelectron Study of the Influence of the Amount of Carbon Nickel-Containing Nanostructures on the Degree of the Polymethylmethacrylate Modification I. N. Shabanova, V. I. Kodolov, N. S. Terebova, V. A. Trapeznikov, N. V. Lomova, G. V. Sapozhnikov, A. V. Obukhov, Ya. A. Polyotov, and N. Yu. IsupovDependence of the Degree of Nanomodification of Polymers on the Content of Oxygen Atoms in Their Structure I. N. Shabanova and N. S. TerebovaFeatures of Deformation Relief of the Surface of the Metal Strip, Obtained by the High Pressure Shear A. V. Sisanbaev, A. A. Demchenko, M. V. Demchenko, A. V. Shalimova, L. R. Zubairov, and R. R. MulyukovThe Structural Analysis of the Microhardness of Plasticized Polypropylene and Its Composites A. L. Slonov, G. V. Kozlov, A. K. Mikitaev, and G. E. ZaikovComposition Modification of the Ti-6al-4v Alloy Surface Layers After Ion-Beam Mixing of Al and Heat Treatment V. L. Vorobiev, P. V. Bykov, S. G. Bystrov, A. A. Kolotov, V. Ya. Bayankin, V. F. Kobziev, and T. M. MakhnevaInfluence of Pulse Laser Beaming With Various Doses on Segregation Processes in Surface Layers of Carbon-Coated Cu50Ni50 Foils A. V. Zhikharev, I. N. Klimova, S. G. Bystrov, V. Ya. Bayankin, E. V. Kharanzhesky, and V. F. KobzievSelf Organization in Processes Under Action Super Small Quantities of Metal/Carbon Nanocomposites: Reviews on Investigation Results V. I. Kodolov and V. V. TrineevaIndex FRONT COVER 1 ABOUT THE SERIES INNOVATIONS IN CHEMICAL PHYSICS AND MESOSCOPY 7 BOOKS IN THE SERIES 9 ABOUT THE EDITORS 11 REVIEWERS AND ADVISORY BOARD MEMBERS 13 CONTENTS 15 LIST OF CONTRIBUTORS 19 LIST OF ABBREVIATIONS 25 LIST OF SYMBOLS 27 PREFACE 31 CHAPTER 1 - THE CALCULATIONS OF THE COMPLEX OF THE RED MERCURIC IODIDE FUNDAMENTAL OPTICAL FUNCTIONS 33 CHAPTER 2 - EXPERIMENTAL RESEARCH OF GRASSY RAGS IGNITION BY HEATED UP TO HIGH TEMPERATURES CARBON PARTICLE 43 CHAPTER 3 - SIMULATION OF STRUCTURAL TRANSFORMATIONS OF SPRING STEEL DURING THE QUENCHING PROCESS 51 CHAPTER 4 - DEFINITION OF THERMOCHEMICAL CHARACTERISTICS FOR DISPERSED CONDENSED SUBSTANCE IGNITION IN THE CONDITIONS OF LOCAL ENERGY SUPPLY 61 CHAPTER 5 - INFLUENCE OF ELECTRON BEAM PARAMETERS ON IGNITION OF ENERGETIC MATERIALS 73 CHAPTER 6 - COMPUTER SIMULATING OF SOLID SOLUTION AgXPb1−XS1−δ HYDROCHEMICAL DEPOSITION PROCESS 85 CHAPTER 7 - CALCULATIONS OF THE AFFINITY FOR ELECTRON VIA THE VALUES OF SPATIAL-ENERGY PARAMETERS 93 CHAPTER 8 - KINETICS OF MOLECULAR DESORPTION IN A SPHERICAL NANOPORE 111 CHAPTER 9 - CALCULATING GAS FLOW IN POLYBUTADIENE PORES DURING PYROLYSIS 121 CHAPTER 10 - POST-CASCADE SHOCK WAVES INFLUENCE ON VACANCY PORES STRUCTURAL TRANSFORMATIONS 131 CHAPTER 11 - ELECTRONIC STRUCTURE OF PLUMBUM SELENIDE 141 CHAPTER 12 - SIMULATION OF POLLUTANTS GENERATION IN THE COMBUSTION CHAMBER OF THE GAS TURBINE POWER PLANT 151 CHAPTER 13 - THE EXCITON SPECTRA OF STRONTIUM SULFIDE 157 CHAPTER 14 - SIMULATION OF THE INTERACTION OF FULLERENE AND IRON FE (100) 163 CHAPTER 15 - FORMATION, OPTICAL AND ELECTRICAL PROPERTIES OF Ca3Si4 FILMS AND Si/Ca3Si4/Si (111) DOUBLE HETEROSTRUCTURES 173 CHAPTER 16 - STRUCTURAL AND CHEMICAL TRANSFORMATIONS OF THE MECHANO-ACTIVATED CALCIUM LACTATE IN VORTEX MILL 183 CHAPTER 17 - NONMONOTONIC CHANGE OF THE COMPOSITION OF SURFACE LAYERS OF THE MELT Co57 Ni10Fe5Si11B17 DURING ISOTHERMAL PROCESS 193 CHAPTER 18 - NICKEL(II) AND ETHYLENEDIAMINETETRAACETATE ACID INTERREACTION IN WATER SOLUTION OF AMINOPROPIONIC ACID 201 CHAPTER 19 - EFFECT OF MAGNETIC FIELD AND UV RADIATION ON STRUCTURAL STATE AND BIOLOGICAL PROPERTIES OF OLEIC ACID AND OLIVE OIL 213 CHAPTER 20 - METASTABLE INTERSTITIAL PHASES BY BALL MILLING OF TITANIUM IN LIQUID HYDROCARBONS 221 CHAPTER 21 - PARAMETERS OF MOBILITY FOR POLLUTION BY SODIUM ARSENITE FOR SOIL OF KAMBARKA DISTRICT 235 CHAPTER 22 - X-RAY PHOTOELECTRON STUDY OFTHE INFLUENCE OF THE AMOUNT OF CARBON NICKEL-CONTAINING NANOSTRUCTURES ON THE DEGREE OF THE POLYMETHYLMETHACRYLATE MODIFICATION 243 CHAPTER 23 - DEPENDENCE OF THE DEGREE OF NANOMODIFICATION OF POLYMERS ON THE CONTENT OF OXYGEN ATOMS IN THEIR STRUCTURE 251 CHAPTER 24 - FEATURES OF DEFORMATION RELIEF OF THE SURFACE OF THE METAL STRIP, OBTAINED BY THE HIGH PRESSURE SHEAR 261 CHAPTER 25 - THE STRUCTURAL ANALYSIS OF THE MICROHARDNESS OF PLASTICIZED POLYPROPYLENE AND ITS COMPOSITES 269 CHAPTER 26 - COMPOSITION MODIFICATION OF THE TI-6AL-4 V ALLOY SURFACE LAYERS AFTER ION-BEAM MIXING OF AL AND HEAT TREATMENT 277 CHAPTER 27 - INFLUENCE OF PULSE LASER BEAMING WITH VARIOUS DOSES ON SEGREGATION PROCESSES IN SURFACE LAYERS OF CARBON-COATED Cu50Ni50 FOILS 285 CHAPTER 28 - SELF-ORGANIZATION IN PROCESSES UNDER ACTION SUPER SMALL QUANTITIES OF METAL/CARBON NANOCOMPOSITES: REVIEWS ON INVESTIGATION RESULTS 295 BACK COVER 365