Theory of electron degradation and yields of initial molecular species produced by ionizing radiation

Theory of lone pairs. IV. Molecular ion

Theory of lone pairs. IV. Molecular ion hole states of ten-electron hydrides. Molecular ionization potentials and proton affinities by direct SCF calculations

✍ C. Kozmutza; E. Kapuy; M. A. Robb; R. Daudel; I. G. Csizmadia 📂 Article 📅 1982 🏛 John Wiley and Sons 🌐 English ⚖ 504 KB

## Abstract Closed‐shell SCF calculations on the ground states and direct SCF calculations on the ionized doublet states were carried out for a series of ten‐electron hydrides. The correlation of ionization potentials with the degree of protonation and the nuclear charge has been studied for hole s