| Initial steps in PEO decomposition on a Li metal electrode A Mirsakiyeva, M Ebadi, CM Araujo, D Brandell, P Broqvist, J Kullgren The Journal of Physical Chemistry C 123 (37), 22851-22857, 2019 | 82 | 2019 |
| Breakdown of polarons in conducting polymers at device field strengths MR Mahani, A Mirsakiyeva, A Delin The Journal of Physical Chemistry C 121 (19), 10317-10324, 2017 | 18 | 2017 |
| Temperature dependence of band gaps and conformational disorder in PEDOT and its selenium and tellurium derivatives: Density functional calculations A Mirsakiyeva, HW Hugosson, M Linares, A Delin The Journal of Chemical Physics 147 (13), 2017 | 5 | 2017 |
| Quantum molecular dynamical calculations of PEDOT 12-oligomer and its selenium and tellurium derivatives A Mirsakiyeva, HW Hugosson, X Crispin, A Delin Journal of Electronic Materials 46, 3071-3075, 2017 | 4 | 2017 |
| Electronic and optical properties of conducting polymers from quantum mechanical computations A Mirsakiyeva KTH Royal Institute of Technology, 2017 | 3 | 2017 |
| Experimental and density functional theory studies of some novel piperidine-containing acetylene glycols A Mirsakiyeva, D Botkina, K Elgammal, A Ten, HW Hugosson, A Delin, ... Arkivoc, 86-99, 2016 | 2 | 2016 |
| Ab Inition Molecular Dynamics on Conjugated Polymers: Localization of the Polaron HW Hugosson, A Mirsakiyeva | | 2022 |
| Understanding of the charge carriers dynamics in poly (p-phenylene) under external electric and magnetic fields MR Mahani, A Mirsakiyeva, A Delin APS March Meeting Abstracts 2017, X9. 012, 2017 | | 2017 |
| Optical properties of Naphthobischalcogenadiazoles from density functional perspective A Mirsakiyeva, M Linares, A Delin | | 2017 |
| Polaron formation and optical absorption in PEDOT and its selenium and tellurium derivatives: density functional calculations A Mirsakiyeva, M Linares, A Delin | | 2017 |
| Charge transport via polarons in doped poly (p-phenylene) with impurity MR Mahani, A Mirsakiyeva, A Delin | | 2017 |
| Experimental and ab initio studies of the novel piperidine-containing acetylene glycols A Mirsakiyeva, D Botkina, K Elgammal, A Ten, HW Hugosson, A Delin, ... arXiv preprint arXiv:1503.08041, 2015 | | 2015 |
| Quantum Mechanical Calculations of Thermoelectrical Polymers and Organic Molecules A Mirsakiyeva KTH Royal Institute of Technology, 2015 | | 2015 |
