Global ETD Search
Search theses and dissertations gathered from participating repositories worldwide. Every result links back to the library that holds it. No account is needed.
Results
Showing 1 to 1 of 1 for “"DKS2-RI"”.
-
Development, validation, and application of new relativistic methods for all-electron unrestricted two-component calculations of EPR parameters
… two-component DFT approach for the unrestricted calculations of electronic g-tensors, based on DKH Hamiltonian. Additionally we have derived the expressions for the evaluation of hyperfine structurs and two-component unrestricted treatment of g-tensor within the Resolution of Identity …