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2. Molar ionization energies of the elements - Wikipedia

   en.wikipedia.org/wiki/Molar_ionization_energies...

   These tables list values of molar ionization energies, measured in kJ⋅mol −1. This is the energy per mole necessary to remove electrons from gaseous atoms or atomic ions. The first molar ionization energy applies to the neutral atoms.

3. List of chemical process simulators - Wikipedia

   en.wikipedia.org/wiki/List_of_chemical_process...

   This is a list of software used to simulate the material and energy balances of chemical process plants. Applications for this include design studies, engineering studies, design audits, debottlenecking studies, control system check-out, process simulation, dynamic simulation, operator training simulators, pipeline management systems, production management systems, digital twins.

4. Joule per mole - Wikipedia

   en.wikipedia.org/wiki/Joule_per_mole

   [1] [2] For example, the Gibbs free energy of a compound in the area of thermochemistry is often quantified in units of kilojoules per mole (symbol: kJ·mol −1 or kJ/mol), with 1 kilojoule = 1000 joules. [3] Physical quantities measured in J·mol −1 usually describe quantities of energy transferred during phase transformations or chemical ...

5. List of quantum chemistry and solid-state physics software

   en.wikipedia.org/wiki/List_of_quantum_chemistry...

   Quantum chemistry computer programs are used in computational chemistry to implement the methods of quantum chemistry. Most include the Hartree–Fock (HF) and some post-Hartree–Fock methods. They may also include density functional theory (DFT), molecular mechanics or semi-empirical quantum chemistry methods .

6. Computational chemistry - Wikipedia

   en.wikipedia.org/wiki/Computational_chemistry

   Computational chemistry is a branch of chemistry that uses computer simulations to assist in solving chemical problems. [1] It uses methods of theoretical chemistry incorporated into computer programs to calculate the structures and properties of molecules , groups of molecules, and solids. [ 2 ]

7. Energy density Extended Reference Table - Wikipedia

   en.wikipedia.org/wiki/Energy_density_Extended...

   Energy densities table Storage type Specific energy (MJ/kg) Energy density (MJ/L) Peak recovery efficiency % Practical recovery efficiency % Arbitrary Antimatter ...