Sentence examples for spin multiplicity from inspiring English sources

The symmetry, spin multiplicity, and energy difference are given below them.

Interestingly, we observed that increasing the spin multiplicity of clusters to 4, 5, and 6 do not affect final structure of the clusters; however, clusters with higher spin multiplicity are very unstable energetically (in some cases more than 2 eV).

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The quality of the present approach becomes also evident by observing that the energetic order of the spin multiplicity is fulfilled for all considered transition metal complexes.

Their symmetry, spin multiplicity, and energy difference compared to each of the most stable structures are also indicated in the figure.

Combining with first-principles calculations, based on the density functional theory (DFT), we find that all of the ground state structures of clusters prefer to keep low spin multiplicity and form planar structures.

The calculations were performed for all possible spin multiplicities.

In total, nine local minima representing six Al4O4 isomers of various spin multiplicities are completely characterised.

Spin multiplicities are given as follows: s (singlet), d (doublet), t (triplet), m (multiplet), or br (broad).

Finally, a projection along the J resolved dimension is calculated leading to almost disappearance of proton proton spin multiplicities in the 2D tilt HMBC spectrum.

The effects of different EG on the spin multiplicities of the ground states and their stabilities were investigated by means of the AM1-CI approach.