Author

Malik Shafqat Hayat

Institution: Emerson University, Multan

Observed institutions: Bahauddin Zakariya University, Emerson University, Multan

ORCID: 0009-0009-8740-7914

Observed ORCIDs: 0009-0009-8740-7914, 0000-0001-8608-6092

OpenAlex ID: A5092660130

A DFT engineering of double halide type perovskites Cs2SiCl6, Cs2GeCl6, Cs2SnCl6 for optoelectronic applications

2022 · Malik Shafqat Hayat, R.M. Arif Khalil · Solid State Communications · 55

Ab-initio exploration of unique and substantial computational properties of double hydrides Cs2CaTlH6, Cs2SrTlH6, & Cs2BaTlH6, for the computational manufacturing of hydrogen fuel cell: A DFT study

2023 · Malik Shafqat Hayat, R.M. Arif Khalil · Journal of Molecular Graphics and Modelling · 41

Computational predictions of optoelectronic energy materials Cs2SiBr6 Cs2GeBr6 & Cs2SnBr6 for phenomenal photovoltaic applications; a first principles study

2024 · Malik Shafqat Hayat, R.M. Arif Khalil · Computational and Theoretical Chemistry · 29

First-principles study of novel Cs 2 LuCoH 6 and Cs 2 LuZnH 6 double hydride perovskites for hydrogen storage applications

2026 · Rasmiah S. Almufarij, Malik Shafqat Hayat, et al. · RSC Advances · 5

First-principles study of lutetium-based double hydride perovskites (Cs₂CaLuH₆, Cs₂SrLuH₆, Cs₂BaLuH₆) as promising materials for hydrogen energy fuel cells: a DFT study

2025 · Malik Shafqat Hayat, R. M. Arif Khalil, et al. · Journal of Molecular Modeling · 4

Exploring Cs-based double halide perovskites for energy applications: a study of thermoelectric, optical, and spin-polarized magnetic properties

2025 · Malik Shafqat Hayat, R. M. Arif Khalil, et al. · Journal of Materials Science Materials in Electronics · 4

DFT engineering of lanthanide-doped Cs2Snx−2RE2Cl6 (RE = La, Ce, Pr, Nd) double perovskites: Tailoring optoelectronic, magnetic and mechanical properties for photovoltaic applications

2025 · Malik Shafqat Hayat, Rana Muhammad Arif Khalil, et al. · Journal of Rare Earths · 3

The Ab-Initio Investigation of Structural, Electronic, Mechanical, Dynamical and Thermodynamic Properties of Double Halide Cs2SrTaCl6, Cs2SrTaBr6, and Cs2BaTaBr6 Perovskites: A Dispersion Corrected DFT Study

2025 · Malik Shafqat Hayat, R. M. Arif Khalil, et al. · Journal of Inorganic and Organometallic Polymers and Materials · 2

Author response for "First-principles study of novel Cs 2 LuCoH 6 and Cs 2 LuZnH 6 double hydride perovskites for hydrogen storage applications"

2026 · Rasmiah S. Almufarij, Malik Shafqat Hayat, et al. · Publons reviews and discussion

Works count: 9

Citation count: 143

H-index: 4

I10-index: 3