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	Science > Chemistry
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	293 items are in this category. Listing items 201 to 293:

	Physical Chemistry: Statistical Mechanics [in Books] Physical Chemistry: Thermodynamics [in Books] Polarizabilities of Fullerenes C20 Through C240 from Atom Monopole-Dipole Interaction Theory [in Articles] Polydimethylsiloxane-Urea-Urethane Copolymers with 1,4-Benzenedimethanol as Chain Extender [in Articles] Ponchon Savarit Graphical Equilibrium Stage Method [in MathSource: Packages and Programs] Power Spectrum of a Function [in MathSource: Packages and Programs] Prediction of Conversion with an Isothermal Axially-Dispersed Plug Flow Reactor [in MathSource: Packages and Programs] Prediction of the Solubility of Orange Essential Oil in High Pressure CO2 [in MathSource: Packages and Programs] Pressure-volume isotherms for a Bragg-Williams lattice gas [in MathSource: Packages and Programs] Process identification using impulse response and normalized moments [in MathSource: Packages and Programs] Production of Enriched Air by Membrane Separation [in MathSource: Packages and Programs] Production of SynGas using Coal-Steam reactions [in MathSource: Packages and Programs] Protein Structure Analysis and Prediction [in Articles] Quantitative Expressions of Dynamic Kinetic Resolution of Chirally Labile Enantiomers: Stereoselective Hydrogenation of 2-Substituted 3-Oxo Carboxylic Esters Catalyzed by BINAP-Ruthenium(II) Complexes [in Articles] Quantum Mathematica [in MathSource: Packages and Programs] Quasilinear Solution Sequence for Nonlinear Tubular Reactor with Dispersion [in MathSource: Packages and Programs] Rate Constants and Thermodynamic Parameters of Rotation of Axial Ligands in a Bisligated Ferric Tetramesitylporphyrinate Complex Measured from the Temperature Dependence of ^1H Transverse Relaxation Rates [in Articles] The ratio of the number of ortho- to para-hydrogen molecules at equilibrium [in MathSource: Packages and Programs] RCM of a Nonideal Ternary Mixture using StreamPlot [in MathSource: Packages and Programs] Reaction Extent Computation of the Decomposition of Pure Nitrogen Tetroxide [in MathSource: Packages and Programs] Reaction-Diffusion Lab [in MathSource: Packages and Programs] ReactionKinetics—A Mathematica package with applications [in Articles] Rearrangements of Model (H2O)8 and (H2O)20 Clusters [in Articles] Rectifying and Stripping Cascade Trajectories for Isopropyl Acetate Chemistry [in MathSource: Packages and Programs] Rectifying and Stripping Profiles for the Reactive Cascade [in MathSource: Packages and Programs] Residence Time Distribution and Conversion Calculations for Tanks in Series Model [in MathSource: Packages and Programs] Residue Curve Map Computation using UNIQUAC Model: Case of a Quaternary Reactive System [in MathSource: Packages and Programs] Residue Curve Map for Homogeneous Reactive Quaternary Mixtures [in MathSource: Packages and Programs] Residue Curve Map for the MTBE/Methanol/isobutene/n-butane mixture at P=1 atm [in MathSource: Packages and Programs] Rigorous Distillation Dynamics Simulations Using a Computer Algebra System [in Articles] Schwarz' D Minimal Surface and the {6, 4} tilling [in MathSource: Packages and Programs] Selection of Optimum Chemical Reactor Design [in MathSource: Packages and Programs] Self-Modifying Code in Virtual Kinetics Laboratory [in Conference Proceedings] Separation of a water-methanol mixture using a four stage batch distillation column [in MathSource: Packages and Programs] Separation of Air using Complete Mixing, Cross-Flow and Countercurrent-Flow Models [in MathSource: Packages and Programs] Separation Problems Using Mathematica [in MathSource: Packages and Programs] Simple Analytical Representation of Atomic Electron Charge Densities, Electrostatic Potentials, and Local Exchange Potentials [in Articles] Simple Batch Distillation of a Binary Mixture [in MathSource: Packages and Programs] Simplifying SAW calculations [in Articles] Simulating Electrochemical Reactions with Mathematica [in Books] Simulation and interpretation of 2D diffraction patterns from self-assembled nanostructured films at arbitrary angles of incidence: From grazing incidence (above the critical angle) to transmission perpendicular to the substrate [in Articles] Singular Point Analysis in Reactive Distillation [in MathSource: Packages and Programs] Solution of Difference and Fredholm Equations [in MathSource: Packages and Programs] Solution of Unsteady Heat Conduction in an Insulated Rod using the Orthogonal Collocation Method [in MathSource: Packages and Programs] Solving Buffering Problems with Mathematica Software [in Articles] Solving the Maxwell-Stefan equations using the orthogonal collocation and the shooting methods [in MathSource: Packages and Programs] Some Comments on the Electrostatic Potential of a Molecule [in Articles] Some Methods for Counting the Spanning Trees in Labeled Molecular Graphs, Examined in Relation to Certain Fullerenes [in Articles] Spin-Adapted States: A Basis for Quantum Dot Structure Calculation [in Articles] Structure, Dynamics, and Thermodynamics of Clusters: Tales from Topographic Potential Surfaces [in Articles] Structures and Rearrangements of Model Silicon Clusters [in Articles] Study of a Binary Mixture of Methane and Propane using the Virial Equation of State [in MathSource: Packages and Programs] Study of the dynamic behavior of Three-Variable Autocatalator [in MathSource: Packages and Programs] Successive First-Order Reversible Reactions [in MathSource: Packages and Programs] Supercritical Adsorption in Small Pores [in Articles] Sur L'Identifiabilité Structurelle de la Réaction de Volmer-Heyrovsky [in Articles] Surface Chemistry in the Aquatic and Atmospheric Sciences [in Courseware and Class Materials] Survival Guide For Physical Chemistry [in Books] Symbolic Algebra in the Analysis of Dynamic Chemical-Kinetic Systems [in Articles] A Symbolic and Graphical Gene Regulation Model of the lac Operon [in Conference Proceedings] Symbolic NMR Product Operator Calculations [in Articles] Symbolic preprocessing for simulation of PDE models of chemical processes [in Articles] Symmetry Operations of Crystallographic Point Groups and Space Groups [in MathSource: Packages and Programs] Systematic Determination of Azeotropes for the Acetone - Chloroform - Methanol Mixture Using Relative Volatility Functions [in MathSource: Packages and Programs] Temperature control of a water tank [in MathSource: Packages and Programs] Temperature-Programmed Gas Chromatography [in Books] Three different methods to determine the concentration profile for a tubular reactor with axial dispersion [in MathSource: Packages and Programs] Time- and Loading-Dependence in the McKone Model for Dermal Uptake of Organic Chemicals from a Soil Matrix [in Articles] Torsional Dependence of Molecular Electrical Properties and Long-range Interactions: CH3OH- Rare Gas Systems [in Articles] Transient diffusion of mass within an infinitely long cylinder: The finite Hankel transform [in MathSource: Packages and Programs] Two-Dimensional Atomic and Molecular Orbital Displays Using Mathematica [in Articles] A Two-Step Computer-Assisted Method for Deriving Steady-State Rate Equations [in Articles] Type I and II liquid-liquid equilibrium diagrams for two ternary systems: water – ethyl acetate – acetone at 288.15 K and hexane – heptane – methanol at 306 K [in MathSource: Packages and Programs] An Ultrasonic Flexural Plate-Wave Sensor for Measurement of Diffusion in Gels [in Articles] Uncovering Oscillations, Complexity, and Chaos in Chemical Kinetics Using Mathematica [in Articles] Unsteady-State Diffusion and Reaction in a Semi-infinite Medium [in MathSource: Packages and Programs] Unsteady-State Heat Conduction using the Schmidt Numerical Method [in MathSource: Packages and Programs] Use of Binding Site Neighbor-Effect Parameters to Evaluate the Interactions between Adjacent Ligands on a Linear Lattice [in Articles] Using Computer Algebra Methods to Determine the Chemical Dimension of Finitely Ramified Sierpinski Carpets [in Articles] Using Symbolic Computing in Building Probabilistic Models for Atoms [in Articles] Vapor Phase Solubility of Decane in Nitrogen at 50°C [in MathSource: Packages and Programs] Vapor-Liquid Equilibrium Computations using PR and SRK Equations of State for the heptane/hexane binary mixture at 760 mmHg [in MathSource: Packages and Programs] Vapor-Liquid Equilibrium Diagram of Ethane-Benzene at 25°C and 175°C [in MathSource: Packages and Programs] Vapor-Liquid Equilibrium Diagram of Ethanol-Ethyl Acetate at 760 mmHg Using Van Laar and UNIQUAC Models [in MathSource: Packages and Programs] Vapour-Liquid Equilibrium Data Computation for a Partially Miscible Binary System using UNIQUAC and NRTL models [in MathSource: Packages and Programs] Visualization of Wave Functions Using Mathematica [in Articles] Visualizing Chemical Structures with Mathematica and XML [in Demos] Visualizing the Physics of Material--Part II [in Articles] VLE computations using Mathematica 7.0 [in MathSource: Packages and Programs] VLLE Computation using Two-Parameter Margules Model: Case of a Ternary System Water-Ethanol-Ethyl Acetate [in MathSource: Packages and Programs] Wei-Prater Mechanism [in MathSource: Packages and Programs] "You're Doing Simulations with Your Students, so Why Are You Using Mathematica?" [in Conference Proceedings] The [FHCL]- Molecular Anion: Structural Aspects, Global Surface, and Vibrational Eigenspectrum [in Articles]
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