activity
20172023
most citedAb-initio design of new Heusler materials for thermoelectric applications

35 citations · 52 across the 5 of their papers we have counts for

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cond-mat.mtrl-sci20195 cited

\textit{Ab initio} study of Bi-based half Heusler alloys as potential thermoelectric prospects

Sapna Singh, Mohd Zeeshan, Jeroen van den Brink +1

We investigated six heavy element bismuth-based 18-VEC half-Heusler alloys CoTiBi, CoZrBi, CoHfBi, FeVBi, FeNbBi, and FeTaBi by first principles approach, in search of better therm…

cond-mat.mtrl-sci2019

First-principles investigations of orthorhombic-cubic phase transition and its effect on thermoelectric properties in cobalt-based ternary alloys

Sapna Singh, Mohd Zeeshan, Jeroen van den Brink +1

We screened six cobalt-based 18-VEC systems CoVSi, CoNbSi, CoTaSi (Si-group) and CoVGe, CoNbGe, CoTaGe (Ge-group) by the first-principles approach, with the motivation of stabilizi…

cond-mat.mtrl-sci2018

Polytypism at its best: improved thermoelectric performance in Li based Nowotony-Juza phases

Uday Chopra, Mohd Zeeshan, Shambhawi Pandey +3

In principle thermoelectricity is a viable route of converting waste heat into electricity, but the commercialization of the technology is limited by its present efficiency. In que…

cond-mat.mtrl-sci2018

FeTaSb and FeMnTiSb as promising thermoelectric materials: An ab initio approach

Mohd Zeeshan, Tashi Nautiyal, Jeroen van den Brink +1

Thermoelectricity in principle provides a pathway to put waste heat to good use. Motivated by this we investigate thermal and electrical transport properties of two new Fe-based He…

cond-mat.mtrl-sci201710 cited

Hole-doped cobalt-based Heusler phases as prospective high-performance high-temperature thermoelectrics

Mohd Zeeshan, Jeroen van den Brink, Hem C. Kandpal

Materials design based on first-principles electronic calculations has proven a fruitful strategy to identify new thermoelectric materials with a favorable figure of merit. Recent…