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Article
Study of band structure, transport and magnetic properties of BiFeO3–TbMnO3 composite
Charge transfer across the interface of two materials in a composite can create reconstruction of bands near the interface which in turn brings multiple changes in physical properties of the materials. Thus, i...
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Article
Evaluation of intramolecular charge transfer state of 4-N, N-dimethylamino cinnamaldehyde using time-dependent density functional theory
Intramolecular charge transfer of 4-N,N-dimethylamino cinnamaldehyde (DMACA) in vacuum and in five different aprotic solvents has been studied by using time-dependent density functional theory (TDDFT). Polarizabl...