Synergistically enhanced polysulfide chemisorption using a flexible hybrid separator with N and S dual-doped mesoporous carbon coating for advanced lithium–sulfur batteries J Balach, HK Singh, S Gomoll, T Jaumann, M Klose, S Oswald, M Richter, ...
ACS applied materials & interfaces 8 (23), 14586-14595, 2016
165 2016 High-throughput design of D Ohmer, G Qiang, I Opahle, HK Singh, H Zhang
Physical Review Materials 3 (5), 053803, 2019
58 2019 High-throughput screening of magnetic antiperovskites HK Singh, Z Zhang, I Opahle, D Ohmer, Y Yao, H Zhang
Chemistry of Materials 30 (20), 6983-6991, 2018
52 2018 Ab initio design of new cobalt-based half-Heusler materials for thermoelectric applicationsM Zeeshan, HK Singh, J van den Brink, HC Kandpal
Physical Review Materials 1 (7), 075407, 2017
48 2017 Designing of magnetic MAB phases for energy applications C Shen, Q Gao, NM Fortunato, HK Singh, I Opahle, O Gutfleisch, H Zhang
Journal of Materials Chemistry A 9 (13), 8805-8813, 2021
42 2021 Stability predictions of magnetic M2AX compounds D Ohmer, I Opahle, HK Singh, H Zhang
Journal of Physics: Condensed Matter 31 (40), 405902, 2019
38 2019 Two-dimensional buckling structure induces the ultra-low thermal conductivity: a comparative study of the group GaX (X= N, P, As) C Shen, N Hadaeghi, HK Singh, T Long, L Fan, G Qin, H Zhang
Journal of Materials Chemistry C 10 (4), 1436-1444, 2022
28 2022 Multifunctional antiperovskites driven by strong magnetostructural coupling HK Singh, I Samathrakis, NM Fortunato, J Zemen, C Shen, O Gutfleisch, ...
npj Computational Materials 7 (1), 1-9, 2021
26 2021 Giant voltage-induced modification of magnetism in micron-scale ferromagnetic metals by hydrogen charging X Ye, HK Singh, H Zhang, H Geßwein, MR Chellali, R Witte, A Molinari, ...
Nature communications 11 (1), 4849, 2020
24 2020 Theoretical prediction of a stable 2D crystal of vanadium porphyrin: A half-metallic ferromagnet HK Singh, P Kumar, UV Waghmare
The Journal of Physical Chemistry C 119 (45), 25657-25662, 2015
23 2015 First-principles study of thermoelectric properties of Li-based Nowotony–Juza phases U Chopra, M Zeeshan, S Pandey, R Dhawan, HK Singh, J van den Brink, ...
Journal of Physics: Condensed Matter 31 (50), 505504, 2019
14 2019 Enhanced anomalous Nernst effects in ferromagnetic materials driven by Weyl nodes I Samathrakis, T Long, Z Zhang, HK Singh, H Zhang
Journal of Physics D: Applied Physics 55 (7), 074003, 2021
13 2021 Effect of N, C, and B interstitials on the structural and magnetic properties of alloys with I Opahle, HK Singh, J Zemen, O Gutfleisch, H Zhang
Physical Review Research 2 (2), 023134, 2020
13 2020 Role of atypical temperature-responsive lattice thermal transport on the thermoelectric properties of antiperovskites Mg3XN (X= P, As, Sb, Bi) J Yue, Y Liu, W Ren, S Lin, C Shen, HK Singh, T Cui, T Tadano, H Zhang
Materials Today Physics 41, 101340, 2024
12 2024 Thermodynamical and topological properties of metastable Fe3 Sn C Shen, I Samathrakis, K Hu, HK Singh, N Fortunato, H Liu, O Gutfleisch, ...
npj Computational Materials 8 (1), 248, 2022
12 2022 High-throughput screening of half-antiperovskites with a stacked kagome lattice HK Singh, A Sehrawat, C Shen, I Samathrakis, I Opahle, H Zhang, R Xie
Acta Materialia 242, 118474, 2023
11 2023 Strain dependence of Berry-phase-induced anomalous Hall effect in the non-collinear antiferromagnet Mn3NiN F Johnson, D Boldrin, J Zemen, D Pesquera, J Kim, X Moya, H Zhang, ...
Applied Physics Letters 119 (22), 2021
11 2021 Tunable anomalous Hall and Nernst effects in MM′ X compounds I Samathrakis, N Fortunato, HK Singh, C Shen, H Zhang
Journal of Physics: Condensed Matter 35 (2), 025703, 2022
10 2022 Phase equilibria of the Zn-Ti system: Experiments, first-principles calculations and Calphad assessment SM Liang, HK Singh, H Zhang, R Schmid-Fetzer
Calphad 64, 213-224, 2019
10 2019 Epitaxy Induced Highly Ordered Sm2 Co17 –SmCo5 Nanoscale Thin-Film Magnets S Sharma, A Zintler, D Günzing, J Lill, DM Meira, R Eilhardt, HK Singh, ...
ACS Applied Materials & Interfaces 13 (27), 32415-32423, 2021
9 2021