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Monte carlo simulation of molecules and ions in liquid water

Monte carlo simulation of molecules and ions in liquid water

Monte carlo simulation of molecules and ions in liquid water

... MONTE CARLO SIMULATION OF MOLECULES AND IONS IN LIQUID WATER MICHAEL YUDISTIRA PATUWO (B.Sc.(Hons), NUS) A THESIS SUBMITTED FOR THE DEGREE OF DOCTOR OF PHILOSOPHY IN SCIENCE DEPARTMENT OF ... Regardless, magnetic interactions due to both electronic and nuclear spin are generally too small to be considered in the context of intermolecular forces, and they are often safely and reasonably ... the sum of the p—irwise inter—™tionsF „his isD of ™ourseD — m—jor ™on™ern th—t often pl—gues simul—tions of very l—rge —ssem˜liesF gorre™tions of su™h s™—le would ™onsume — l—rge —mount of ™omput—tion—l...
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Monte carlo simulation of light propagation in stratified water

Monte carlo simulation of light propagation in stratified water

... vii Monte Carlo simulation of light propagation in stratified water Summary The spectral reflectance of the sea surface contains information about light absorption and scattering properties of water ... of a stratified ocean…………………………….48 Section 3.4 Oceanographic observations of the presence of inhomogeneity in the water column……………………… 49 IV Monte Carlo simulation of light penetration in water …………56 ... ocean and a continuously stratified one, although the agreement is better for a two-layer ocean viii Monte Carlo simulation of light propagation in stratified water Then the influence of vertical...
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Báo cáo lâm nghiệp:

Báo cáo lâm nghiệp: "Effects of the clear-cutting of a Douglas-fir plantation (Pseudotsuga menziesii F.) on the chemical composition of soil solutions and on the leaching of DOC and ions in drainage waters" pps

... indicates an interaction between spatial and temporal variability The temporal variability mainly consisted in seasonal cycles and in the eect of clear-cutting (decrease in concentrations and disappearance ... II) The ionic balance was dominated by cations with an excess of 318 àmolc L1 over anions Again, the decit of the ionic balance can be explained by organic anions (DOC of 3.2.4.1 Gravitational solutions ... clear-felling of a Sitka spruce stand in a peaty-gley soil in Scotland The behaviour of gravitational solutions with very low and constant concentrations seemed to eliminate a control of their...
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Annual and Diurnal Profiles of Cryptosporidium and Giardia in River Water in Japan

Annual and Diurnal Profiles of Cryptosporidium and Giardia in River Water in Japan

... of River Water Samples To investigate the annual profiles of protozoans, a total of 84 river water samples were collected at sites (sites A-G) in tributary rivers of the Tone River basin in Japan ... Concentrations of Cryptosporidium and Giardia ((oo)cysts/10L) 350 Site G Fig - Annual profiles of the concentrations of Cryptosporidium and Giardia in river water - 228 - Journal of Water and Environment ... closely on the discharge point of treated sewage wastewater Sampling sites for investigating annual profiles Sampling sites for investigating diurnal profiles River flow Tone River Site A Site B Tone...
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Tài liệu Báo cáo khoa học: Suppressed catalytic efficiency of plasmin in the presence of long-chain fatty acids Identification of kinetic parameters from continuous enzymatic assay with Monte Carlo simulation ppt

Tài liệu Báo cáo khoa học: Suppressed catalytic efficiency of plasmin in the presence of long-chain fatty acids Identification of kinetic parameters from continuous enzymatic assay with Monte Carlo simulation ppt

... identify the site of action of the fatty acids in the plasmin molecule, the amidolytic activity of two truncated plasmin variants was examined (Fig 8) Miniplasmin (des-kringle 1-4 plasmin) contains the ... parameters of plasmin in the presence of fatty acids The values of kp and Km were determined from the amidolytic assay of plasmin activity, according to Model I, in the presence of oleate (OA) and ... models of plasmin inhibition Results and Discussion In uence of fatty acids on the plasmin amidolytic assay For determining the exact kinetic parameters of plasmin we chose a simple amidolytic assay...
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Báo cáo

Báo cáo "Monte carlo simulation by code of MCNP and experimental check for measuring thickness of materials for the specializing system of MYO-101 " ppt

... Journal of Science, Mathematics - Physics 26 (2010) 43-49 includes two parts: i) the theoretical simulation of measuring intensity for thickness of materials by the system of MYO-101 with using code ... versus thickness between simulation by MCNP and experimental measurement for aluminum Fig Comparison of count rate versus thickness between simulation by MCNP and experimental measurement for white ... Comparison of count rate versus thickness between simulation by MCNP and experimental measurement for plastic Fig Comparison of count rate versus thickness between simulation by MCNP and experimental...
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Báo cáo nghiên cứu khoa học:

Báo cáo nghiên cứu khoa học: "Monte carlo simulation by code of MCNP and experimental check for measuring thickness of materials for the specializing system of MYO-101" pptx

... Journal of Science, Mathematics - Physics 26 (2010) 43-49 includes two parts: i) the theoretical simulation of measuring intensity for thickness of materials by the system of MYO-101 with using code ... versus thickness between simulation by MCNP and experimental measurement for aluminum Fig Comparison of count rate versus thickness between simulation by MCNP and experimental measurement for white ... Comparison of count rate versus thickness between simulation by MCNP and experimental measurement for plastic Fig Comparison of count rate versus thickness between simulation by MCNP and experimental...
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Tài liệu Báo cáo

Tài liệu Báo cáo " Study on Monte-Carlo calculation of peak efficiencies of the superpure Hp Ge detector (Gmx) in environmental gamma spectrometry with using MCNP4C2 " pptx

... hyperpure HP Ge detector (GMX) based on MCNP4C2 we need to provide an input file containing the information involved to the cross-section library and the description of the physical geometry of the source, ... the source -detector- geometry Application MCNP4C2 for calculation of peak efficiencies of detector (GMX) the hyperpure HP Ge The hyperpure HP Ge detector (GMX) used by us here in simulation and experimental ... electrons in germanium crystal and the field distortions near the edges of the detector are not properly done The modeling of peak efficiencies of the detector has also been considered by us for gamma...
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finance - risk analysis and monte carlo simulation

finance - risk analysis and monte carlo simulation

... obvious risks, and a quicker method of generating multiple model outcomes that you can analyze This is where Monte Carlo simulation comes in handy WHAT IS MONTE CARLO SIMULATION? What we mean by "simulation? " ... add-in to provide this functionality One available simulation add-in for Excel is Crystal Ball 2000, which will be used in this example How did Monte Carlo simulation get its name? Monte Carlo simulation ... produces Crystal Ball® Monte Carlo risk analysis software During his tenure at the company, he has held positions as a Program Manager and as a trainer in Monte Carlo modeling and simulation Mr Goldman...
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Fundamentals of the monte carlo method for neutral and charged particle transport

Fundamentals of the monte carlo method for neutral and charged particle transport

... uses of the Monte Carlo are for the purposes of understanding physical phenomena There are others uses of the Monte Carlo method for purely mathematical reasons, such as the determination of multi-dimensional ... probability theory Fundamental to understanding the operation of a Monte Carlo process and interpreting the results of Monte Carlo calculations, is some understanding of elementary probability theory ... products of both basic and applied science are dependent upon the trinity of measurement, theory and Monte Carlo Monte Carlo is often seen as a “competitor” to other methods of macroscopic calculation,...
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molecular dynamics simulation of thermal and thermomechanical phenomena in picosecond laser material interaction

molecular dynamics simulation of thermal and thermomechanical phenomena in picosecond laser material interaction

... College of Engineering and Technology and the Department of Mechanical Engineering at the University of Nebraska at Lincoln References [1] H H€kkinen, U Landman, Superheating, melting, and a annealing ... sq thermal relaxation time Subscript i index of the atom In this work, MD simulations are conducted to study the thermal and thermomechanical phenomena in laser argon interaction using the laser ... resource in terms of suppressing the statistical uncertainty and revealing macro-scale phenomena in laser ablation This work emphasizes the evolution and propagation of temperature and thermomechanical...
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Báo cáo lâm nghiệp:

Báo cáo lâm nghiệp: "Simulation of wood deformation processes in drying and other types of environmental loading*" ppt

... new method using Kirchhoff potentials to calculate moisture flow in wood In: International Conference on Wood Drying Understanding the Wood Drying Process: A Synthesis of Theory and Practice, ... Research Centre of Finland, Research notes 1276, Espoo, Finland Thelandersson S, Morén T (1990) Tensile stresses and cracking in drying timber In: IUFRO/5.02 TimberEngineering Meeting New Brunswick, ... describes numerical simulation of deformation in wood during drying and other environmental loading Finite element simulations give valuable information on the importance of different material properties...
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A study of conformational response of DNA to nanoconfinement by monte carlo simulation

A study of conformational response of DNA to nanoconfinement by monte carlo simulation

... A Study of Conformational Response of DNA to Nanoconfinement by Monte Carlo Simulation NG SIOW YEE (B.Sc (Hons.), M.Sc (Dist.)) University of Malaya Supervisor: Assoc Prof Johan R C van der Maarel ... program which is designed to simulate the behaviour of a real physical system via a simplified complex model It generates a vast amount of data that need to be statistically analyzed in order to gain ... allows a trial state to be accepted or rejected according to probability A trial state of the system is generated from a trial move applied to previous state A trial move is a type of Monte Carlo...
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Phase separations in protein solutions a monte carlo simulation study

Phase separations in protein solutions a monte carlo simulation study

... separation (a protein- poor phase with low protein concentration and a protein- rich phase with high protein concentration), and a “fluid-solid” phase separation (crystallization) Protein phase separations ... REFERENCES v SUMMARY Phase separations in protein solutions, including liquid-liquid phase separation and liquid-solid phase separation, play an important role in many chemical and biological processes ... understanding protein function At certain conditions, a homogeneous protein solution may separates into two phases There are two types of phase separations in protein solution, a “liquid-liquid” phase...
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