Investigation of the neighborship properties of several monatomic liquids

Article Abstract:

Issues concerning the neighbourship properties of monatomic liquids with reference to structure comparisons are presented.

Potassium (Chemical element), Gallium, Argon, Fluids, Lithium, Mercury, Potassium, Lithium (Metal), Mercury (Metal)

---

Length, strength, extensibility, and thermal stability of Au-Au bond in the gold monatomic chain

Article Abstract:

Research provides insight into the coordination-imperfection-enhanced binding intensity, suppressed thermal stability of MC, which could be extended to the mechanical and thermal behavior of other metallic nanowires. Temperature-dependent extensibility and CN imperfection may be needed for sophisticated density functional theory calculation.

Gold Compounds, Chemical reactions, Density functionals, Density functional theory, Coordination compounds, Complex compounds

---

Etching of the InP (001) surface by halogens: Reaction mechanisms obtained by density-functional calculations

Article Abstract:

In the study conducted, the reaction behavior of differently halogenated surface structures is obtained from calculated reaction energies and related barrier heights are discussed. Practically, a higher temperature has to be used for obtaining a high etch rate because of the transport of the etch gas to and the products from the surface.

Primary nonferrous metals, not elsewhere classified, Primary Smelting and Refining of Nonferrous Metal (except Copper and Aluminum), Phosphorus & Compounds, Elemental Phosphorus, Indium, Phosphorus, Phosphorus (Chemical element), Structure, Chemical properties

Similar abstracts:

• Abstracts: Key steps of the cis-platin-DNA interaction: density functional theory-based molecular dynamics simulations. Formamide hydrolysis investigated by multiple-steering ab initio molecular dynamics
• Abstracts: Laplacian of the electronic charge density and heat of adsorption of O2 and CO molecules on 3d transition metals
• Abstracts: Quantitative determination of the surface concentration of phenazine adsorbed on silver colloidal particles and relationship with the SERS enhancement factor
• Abstracts: Alternative explanation of the difference between translational diffusion and rotational diffusion in supercooled liquids
• Abstracts: Theoretical study of structural and electronic properties of naked stoichiometric and nonstoichiometric indium phosphide cluster

This website is not affiliated with document authors or copyright owners. This page is provided for informational purposes only. Unintentional errors are possible.