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Currently the Calculators On-Line Center contains

over "23,490" Calculators


Chemistry Calculators: E-L

Elastic Photon/Atom Scattering ~ Electrochemistry ~ Electrophoresis

Emission, Absorption & Color Mixing

Enthalpy/Gibbs Energy ~ Equilibrium ~ Evaporation

Extremely Hazardous Substance, Contamination & Chemical Accidents

Ferrous & Non-Ferrous Materials ~ Filtration & Separation

Fluid Phase Equilibria & Equilibrium Vapor Pressure ~ Food Chemistry

Fume Hoods

Gas Laws (Ideal, Boyle's, Avagadro's, van der Waals etc.)

Gas Mixtuers, Gas Dynamics, Natural Gas, etc. ~ Glassblowing

Graphing ~ H2 ~ H2O2 ~ H2O/Water

Helium ~ Inorganic Chemistry Lab Experiments & Demonstrations

Ketones ~ Kinetics & Chemical Kinetics



Chemistry Center
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Gas Mixtures, Gas Dynamics, etc.


Gas Conversions ~ Combustion Dynamics ~ Gas Dynamics

Gas Explosions ~ Gas Mixtures ~ Gas Saturation in Water

Infra-Red Gas Radiation ~ Natural Gas Compressibility

Natural Gas Ignition ~ Thermal Gas-Phase Chemical Reactions

Thermochemical: Gas-Phase Molecules







      THERMOCHEMICAL CALCULATORS & APPLETS: GAS-PHASE MOLECULES

        COMPUTATIONAL CHEMISTRY COMPARISON AND BENCHMARK DATABASE (CCCBDB) - CALCULATED DATA - Computational Chemistry Group, National Institute of Standards and Technology (NIST) Multimedia Thermochemical Database (Text, Images, Calculations, etc...). VERY VERY VERY...EXTENSIVE.
        Computational Chemistry Comparison and Benchmark Database contains
          "...experimental and computational thermochemical data for a selected set of 631 gas-phase molecules. Tools for comparing experimental and computational ideal-gas thermochemical properties..."
        Computational Chemistry Comparison and Benchmark Calculated Data includes:
          Geometric Calculated Data
            "...Cartesians, bond lengths and angles;
            Rotation and Moments of Inertia;
            Bond orders from AIM analysis;
            Point Group for a given molecule at different levels of theory; etc..."
          Vibrations Calculated Data
            "...Vibrational frequencies;
            Vibrational frequencies, intensities and reduced masses;
            Compare reduced masses for a given vibrational mode;
            Bad Vibrational Frequency calculations; etc..."
          Entropies Calculated Data
            Entropies and Integrated Heat Capacities at any temperature using calculated data; etc..."
          Energetics Calculated Data
            Energies in hartrees;
            Barriers to Internal Rotation;
            Nuclear repulsion Energies; etc..."
          Electrostatics Calculated Data
            Atomic charges;
            Electric dipole moments;
            Polarizabilities; etc..."
          Compare Calculations
            "...Compare calculated bond lengths bond lengths;
            Compare calculated vibrational intensities vibrations;
            Compare energy difference of a single point calculation;
            Calculated properties for several species; etc..."
        For more information see Computational Chemistry Comparison and Benchmarks Database; Computational Chemistry Group; NIST Online Databases or the National Institute of Standards and Technology (NIST)








H2O


Alkalinity ~ Boiling Point ~ Gas Saturation in Water

Liquid Tank Heating ~ Properties of Water & Steam

Lakes, Reservoirs, Streams ~ Speed of Sound in Pure Water

Sea Water ~ Water Chemistry ~ Water Vapor Pressure