Sentence examples for intermediates transition from inspiring English sources

The fully optimized geometries of all the reactants, intermediates, transition states (TS), and products involved in the Cd[(C6H5 2PSSe]2 decomposition are shown in Fig. 4.

The geometry optimizations and frequency calculations of all species in this study, such as reactants, intermediates, transition states (TS) and products, were carried out at B3LYP/6-31 B3LYP/6-31.

Figure 10 shows the structures for all the intermediates, transition states, and the β,γ-unsaturated amide 8 in these potentially competitive pathways.

Solvation Gibbs free energies of the relevant intermediates, transition states, and products involved in mechanism 2 relative to the total solvation Gibbs free energies of (Ph)(PMe3 Pd κ-OAc) and quinoline N-oxide are shown in Figure 10.

Solvation Gibbs free energies were calculated for the relevant intermediates, transition states, and products involved in mechanisms 1a c relative to each of the most stable Pd κ-Oquinoline  N -oxide) starting comPd κ-Oquinoline

It lacks intermediate transition layer between the lower parent rock and the surface soils.

A layer of intermediate transition zone containing interwoven amorphous structures formed at their interfaces to lower the interfacial energy.

New peaks (italic) are assigned: 2H9/2 → 4I15/2 transition at 410 nm, 4I9/2 → 4I15/2 transition at 815 nm, and the intermediate transition 2H9/2 → 4I13/2 at 560 nm.

The Mulliken atomic charges on Mo are 0.616, 0.584, and 0.414 respectively, for the substrate bound intermediate, transition state, and product bound intermediate.

The charges on CRH are 0.084, 0.198, and 0.330, respectively, at the substrate bound intermediate, transition state, and product bound intermediate.

Low magnetic field intensities are also observed within the expansion fan with a sharp change at the intermediate transition.