On the performance of generalized valence bond theory in predicting magnetic exchange coupling constant in organic diradicals: A comparison with Hartree-Fock theory

On the performance of generalized valence bond theory in predicting magnetic exchange coupling constant in organic diradicals: A comparison with Hartree-Fock theory

Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Computational and Theoretical Chemistry - Volume 1116, 15 September 2017, Pages 220-224

Sudip Sarkar, Tamal Goswami, Debojit Bhattacharya, Anirban Misra,