
doi: 10.1039/ft9949003261
Two new triatomic molecular ions with C2v symmetry i.e. CO2– and SO2– have been detected in NaCl by means of EPR. By analysing the 13C hyperfine tensor of the CO2– radical the spin densities in the 2s and 2pz carbon atomic orbitals can be calculated. Since the 14N hyperfine tensor of the isoelectronic NO2 molecule in the same host lattice is also known, a comparison between the spin densities in both defects can be made. In addition, the spin densities for both defects are calculated using ab initio methods and are compared with the experimental results.As is the case for the smaller CO2– ion, the SO2– radical is assumed to substitute for only one halide ion. The monovacancy model for the SO2– ion is discussed. Such a model is in accordance with that for the smaller ozonide O3– ion. On the other hand, the larger S3 and Se3– ions occupy a trivacancy site.
| selected citations These citations are derived from selected sources. This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically). | 4 | |
| popularity This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network. | Average | |
| influence This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically). | Average | |
| impulse This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network. | Average |
