Arama Sonuçları - "statistical mechanics"

İstatistik mekaniğe giriş / Yazar: Karaoğlu, Bekir

Konular:

Phase transitions in materials / Yazar: Fultz, Brent

Konular:

Molecular Simulation Studies on Thermophysical Properties With Application to Working Fluids / Yazar: Raabe, Gabriele

İçindekiler: “…Introduction -- Introduction to Statistical Mechanics -- Monte Carlo Simulations -- Molecular Dynamics Simulations -- Running Molecular Simulations -- Molecular Models (Force Fields) -- Thermophysical and Structural Properties from Molecular Simulation -- Applications of Molecular Simulations to Studies on Working Fluids -- Conclusion and Outlook -- A Force Field Parameters.…”
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Probabilistic Cellular Automata Theory, Applications and Future Perspectives /

İçindekiler: “….- Part I Probability and statistical mechanics -- 3 Basic ideas to approach metastability in Probabilistic Cellular Automata -- 4 Strategic Interaction in Interacting Particle Systems -- 5 Scaling and inverse scaling in anisotropic bootstrap percolation -- 6 The sandpile cellular automaton -- 7 Ising Model on the Torus and PCA Dynamics: reversibility, irreversibility, and fast tunneling -- 8 Synchronization in Interacting Reinforced Stochastic Processes -- 9 Nonequilibrium physics aspects of Probabilistic Cellular Automata.- Part II Computer science and discrete dynamical systems -- 10 An example of computation of the density of ones in Probabilistic Cellular Automata by direct recursion -- 11 Statistical equilibrium in deterministic Cellular Automata -- 12 Epidemic automaton and the Eden model: various aspects of robustness -- 13 Convergence time of Probabilistic Cellular Automata on the torus -- 14 Percolation operators and related models -- 15 Phase transitions of Cellular Automata.-  Part III Applications to natural sciences and computational (cell) biology -- 16 A trade-off between simplicity and robustness? …”
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Viscoelasticity of Polymers Theory and Numerical Algorithms / Yazar: Cho, Kwang Soo

İçindekiler: “…I Fundamental Principles -- 1 Preliminary Mathematics -- 2 Continuum Thermo-Mechanics -- 3 Statistical Mechanics -- 4 Polymer Physics -- II Linear Viscoelasticity -- 5 Theory of Linear Viscoelasticity -- 6 Numerical Methods -- 7 Viscoelastic Spectrum -- 8 Time-Temperature Superposition -- 9 Applications to Polymer Systems -- III Nonlinear Viscoelasticity -- 10 Nonlinear Constitutive Equations -- 11 Large Amplitude Oscillatory Shear -- Appendix -- Subject Index.…”
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Statistical Physics for Electrical Engineering Yazar: Merhav, Neri

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Underpotential Deposition From Fundamentals and Theory to Applications at the Nanoscale / Yazar: Oviedo, Oscar Alejandro, Reinaudi, Luis, Garcia, Silvana, Leiva, Ezequiel Pedro Marcos

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Handbook of Computational Chemistry

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The Notion of Activity in Chemistry Yazar: Burgot, Jean-Louis

İçindekiler: “…1st part: The Activity in Classical Thermodynamics -- Thermodynamic systems -- Gibbs and Helmhotz energies -- Escaping tendency and molar Gibbs energy -- Partial molar properties -- Chemical potential or partial molar Gibbs energy -- An overview of the notion of activity -- The concept of fugacity -- Ideal solutions -- Definitions of the activity -- Activity of a gaz -- Activities of non- electrolytes in solutions -- Activities of electrolytes: definitions -- Determination of the activity of non-electrolytes -- Determination of the activity of electrolytes -- Debye and Hückel 's relations -- Excess Gibbs energies and activities -- Chemical equilibrium constants : activities and Gibbs energies of reactions -- Derivation of thermodynamic equilibrium constants- pH and its measure -- General principles of calculations of ionic species concentrations in solutions involving activities -- 2nd part: The Activity in Statistical Thermodynamics -- Statistical thermodynamics in brief -- Concept of ensembles and postulates -- The canonical ensemble: notion of distribution -- Thermodynamic quantities in the framework of the canonical ensemble -- Other ensembles -- Systems of molecules and subsystems independent distinguishable and "indistinguishable" -- Perfect gases -- Classical statistical mechanics- Notion of configuration - Classical canonical partition function -- The configurational partition function - Molecular distribution functions -- The radial distribution function -- Radial distribution function and thermodynamic quantities- calculations of the internal energy and of the pressure of a system -- Radial distribution function and calculation of the isothermal compressibility coefficient of a system -- The chemical potential and the radial distribution function: General formal introduction of the activity and of the activity coefficient -- Imperfect gases - The virial coefficients in terms of interaction potential energies -- A statistical expression of the activity: A relation between it and the concentration in the case of an imperfect gaz -- Activities of gases in a mixture of imperfect gases -- Chemical equilibria between gases and statistical thermodynamics -- Activity coefficients of gases -- Activities and concentrations of non-electrolytes in dilute liquid solutions - McMillan- Mayer's theory of their osmotic pressure -- A study of dilute solutions of non-electrolytes at constant pressure and temperature -- The activity coefficients of solutes in binary non-electrolyte solutions -- Molecular distribution functions in binary mixtures -- The Kirkwood-Buff's theory- Changes of chemical potentials of solutes with their concentrations at constant pressure and temperature -- Expressions of the chemical potentials of the components of ideal solutions of non-electrolytes.…”
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The Role of Water in ATP Hydrolysis Energy Transduction by Protein Machinery

İçindekiler: “…Theoretical studies of strong attractive interaction between macro-anions mediated by multivalent metal cations and related association behavior: Effective interaction between ATP binding proteins can be regulated by hydrolysis -- 5. Statistical mechanical integral equation approach to reveal the solvation effect on hydrolysis free energy of ATP and its analogue -- 6. …”
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Helical Wormlike Chains in Polymer Solutions Yazar: Yamakawa, Hiromi, Yoshizaki, Takenao

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