Sentence examples for basis set was applied from inspiring English sources

The 6-31G d,p) basis set was applied for the C, N, O, H elements and the SDD[ 26] pseudopotential for Ru.

All electron treatment and double numerical plus polarization basis sets are applied for silicon atoms.

The 6 31G** basis set was used.

The 6-31G** baset set was used.

The DZP (siesta) basis set was used.

The DZP basis set was used.

For the Pd atoms, also a single zeta basis set has been applied.

In MD the specific symbol would be the force field atom type while in QM this would be used to specify which basis set should be applied.

The optimized local basis set is able to achieve high accuracy with a small number of basis functions per atom when applied to a one dimensional model problem.

An example of a basis set is the familiar set of sinusoids at all frequencies.

B3LYP and B3P86 functionals with 6-31G** baset set were used.