caa a22 4500 469041153 CHVBK 20180323132811.0 cr unu---uuuuu 170328e19921001xx s 000 0 eng 10.1007/BF02845817 doi (NATIONALLICENCE)springer-10.1007/BF02845817 Covalent binding parameters and the ground state wavefunctions of vanadyl ion complexes [Elektronische Daten] [B Misra, Ajitendra Narayan, R Kripal] The Steven's method of molecular orbitals for octahedral complexes containing transition metal ions has been used for estimating the binding parameters and interpreting theg factors of VO 2 + ion in single crystals. The expressions forg factors have been given in terms ofK ‖ andK ⊥ taking into account the tetragonal crystalline field and covalent binding effects. Computations show thatK ⊥ should be less than 0.066 in order to fit the experimentalg values. The ground state wave function (GSWF) of VO 2 + ion doped in different single crystals has been estimated using crystal field theory. The GSWF is found to be ind xy state with slight admixture of the excited states $$d_{x^2 - y^2 } $$ ,d xz andd yz. The hyperfine interaction parameterP and Fermi contact termX have also been estimated. Indian Academy of Sciences, 1992 Electron spin resonance nationallicence binding parameters nationallicence ground state wavefunction nationallicence hyperfine interaction parameter nationallicence 76.30 nationallicence Misra B. Department of Physics, University of Allahabad, 211 002, Allahabad, India aut Narayan Ajitendra Department of Physics, University of Allahabad, 211 002, Allahabad, India aut Kripal R. Department of Physics, University of Allahabad, 211 002, Allahabad, India aut Pramana Springer India 39/4(1992-10-01), 343-350 0304-4289 39:4<343 1992 39 12043 https://doi.org/10.1007/BF02845817 text/html Onlinezugriff via DOI 1 research-article jats NATIONALLICENCE 856 40 https://doi.org/10.1007/BF02845817 text/html Onlinezugriff via DOI NATIONALLICENCE 700 1- Misra B. Department of Physics, University of Allahabad, 211 002, Allahabad, India aut NATIONALLICENCE 700 1- Narayan Ajitendra Department of Physics, University of Allahabad, 211 002, Allahabad, India aut NATIONALLICENCE 700 1- Kripal R. Department of Physics, University of Allahabad, 211 002, Allahabad, India aut NATIONALLICENCE 773 0- Pramana Springer India 39/4(1992-10-01), 343-350 0304-4289 39:4<343 1992 39 12043 Metadata rights reserved Springer special CC-BY-NC licence nationallicence BK010053 XK010053 XK010000 NATIONALLICENCE NATIONALLICENCE NL-springer