5 papers
Hund's coupling driven nature of magnetism in negative charge transfer material,
Jyotsana Sharma, Shivani Bhardwaj, Sudhir K Pandey
In this work, we investigate the microscopic origin of magnetism in by incorporating electronic correlations within the dynamical mean-field theory (DMFT) framew…
Valence band-satellite, temperature dependent magnetic and spectral study of α-Fe
Trishu Verma, Shivani Bhardwaj, Sudhir K Pandey
We investigate the influence of correlations and plasmonic excitation on valence band-satellite of -Fe, along with magnetic and spectral properties as function of temperature.…
Spin-dependent orbital selectivity and partial Kondo-screening in magnetically ordered Hund's metal
Shivani Bhardwaj, Sudhir K. Pandey
Hund's metallicity in 3 transition metal oxides constitutes a rare class of compounds, since they have been long understood considering the dominance of Hubbard . $\mathrm{Li…
Studying the Seebeck coefficient and exploring the possibility of enhancing ZT upto 1.8 for NaCoO in high temperature region
Rahul Raj, Sudhir K. Pandey
Here, we have studied the temperature dependent Seebeck coefficient (S) of the NaCoO (NCO) by using experimental and computational methods. The range of experimentally obta…
Signatures of Hund metal physics in single-layered 3d transition metal oxide,
Shivani Bhardwaj, Sudhir K Pandey
With density functional theory plus dynamical mean-field theory, we study the influence of Hund's coupling on the nature of electronic correlations in . Our res…