Sentence examples for using the first principles from inspiring English sources

All mathematical expressions in the paper are derived using the first principles.

Using the first principles calculation, a new pentagonal indirect band gap semiconductor namely arsenic carbide monolayer (As2C) is predicted.

In this paper, self-consistent calculation of electronic energy structure of quantum-dimensional periodic matrix of silicon nanowires has been carried out with using the first principles.

In derivatives of trigonometric functions, an individual should know derivatives of basic trigonometric functions without using the first principles of differentiation to prove them.

By using the first principles calculations in the framework of the density functional theory, a new quasi-planer semiconductor material, namely Magnesium Carbide Monolayer (Mg2C) is predicted.

We investigated a variation effect on the insecticide activity of DDT analogues by using the first principles electronic structure calculations and the neural network analysis.

The thermodynamic properties of Al, Ni, NiAl, and Ni3Al were studied using the first-principles approach.

We investigate the electric-field-dependent optical properties and electronic behaviors of GaS monolayer by using the first-principles calculations.

Formation energies of native defects and Pr impurities in orthorhombic CaTiO3 are explored using the first-principles calculations.

Using the first-principles full-potential linearized augmented plane-wave method, we investigate the magnetostriction of Fe4N.

The low-index surfaces of TiC are studied using the first-principles method based on density functional theory.