| Highly efficient transition metal doped C24 electrocatalysts for hydrogen evolution reaction: Kinetic and thermodynamic aspects S Sarfaraz, M Yar, MU Ashraf, K Ayub Materials Science in Semiconductor Processing 168, 107840, 2023 | 12 | 2023 |
| First-principles study of metal-semiconductor contact OF CS and X2CO2 (X= Ti, Zr, Hf) monolayers MU Ashraf, H Khan, M Munawar, HU Din, M Idrees, M Bilal, Y Saeed, ... Materials Science in Semiconductor Processing 141, 106424, 2022 | 11 | 2022 |
| Cavitands based nanocapsule as smart and highly effective vehicle for 5-fluorouracil anti-cancer drug delivery: DFT insights S Sarfaraz, M Yar, M Sohaib, MU Ashraf, K Ayub Journal of Molecular Liquids 399, 124436, 2024 | 10 | 2024 |
| Intriguing interfacial characteristics of the CS contact with MX 2 (M= Mo, W; X= S, Se, Te) and MXY ((X≠ Y)= S, Se, Te) monolayers H Khan, MU Ashraf, M Idrees, HU Din, CV Nguyen, B Amin RSC advances 12 (20), 12292-12302, 2022 | 5 | 2022 |
| Exploring the phonon transport and thermoelectric properties of BAs-MXY (M= Ti, Zr, Hf; X= S, Se; Y= O) van der Waals heterostructures MU Ashraf, Y Xu, M Yar, X Ni, F Tian Materials Science in Semiconductor Processing 183, 108775, 2024 | 3 | 2024 |
| Hydrogen storage application of Zn-based hydride-perovskites: a computational insight M Usman, A Wu, N Bibi, S Rehman, MA Rehman, S Ahmad, ... Optical and Quantum Electronics 56 (9), 1478, 2024 | 2 | 2024 |
| DFT study on the nature of interaction of ionic liquids with self-assembled belt [14] pyridine A Ahsan, MHSA Hamid, I Bayach, NS Sheikh, MU Ashraf, M Yar, K Ayub Materials Science in Semiconductor Processing 190, 109308, 2025 | | 2025 |
| First-principles calculations to investigate Electronic, half-metallicity, thermodynamics, thermoelectric and mechanical properties of new Half-Heusler alloys FeCoZ (Z= Si, Ge … M Touqir, G Murtaza, A Ayyaz, A Usman, MB Shakir, S Saleem, MU Ashraf, ... Computational and Theoretical Chemistry 1244, 115066, 2025 | | 2025 |
| Layer-dependent Schottky contact at TaX 2–BY (X= S, Se, Te; Y= P, As, Sb) van der Waals interfaces IU Haq, A Mustaqeem, B Ali, MU Ashraf, U Khan, M Idrees, M Shafiq, ... Nanoscale Advances 7 (3), 808-818, 2025 | | 2025 |
| CO 2 capturing by self-assembled belt [14] pyridine encapsulated ionic liquid complexes: a DFT study A Ahsan, A Lakhani, MU Ashraf, M Yar, S Sarfaraz, K Ayub RSC advances 14 (43), 31837-31849, 2024 | | 2024 |
Khurshid AyubCOMSATS University AbbottabadE-mailová adresa ověřena na: cuiatd.edu.pk
