| Cu diffusion in single-crystal and polycrystalline TiN barrier layers: A high-resolution experimental study supported by first-principles calculations M Mühlbacher, AS Bochkarev, F Mendez-Martin, B Sartory, L Chitu, ... Journal of applied physics 118 (8), 2015 | 48 | 2015 |
| Formation and interaction of point defects in group IVb transition metal carbides and nitrides VI Razumovskiy, MN Popov, H Ding, J Odqvist Computational Materials Science 104, 147-154, 2015 | 41 | 2015 |
| Response modeling of single SnO2 nanowire gas sensors MZ Asadzadeh, A Köck, M Popov, S Steinhauer, J Spitaler, L Romaner Sensors and Actuators B: Chemical 295, 22-29, 2019 | 36 | 2019 |
| Temperature dependence of surface and grain boundary energies from first principles D Scheiber, O Renk, M Popov, L Romaner Physical Review B 101 (17), 174103, 2020 | 32 | 2020 |
| Atomistic description of self-diffusion in molybdenum: A comparative theoretical study of non-Arrhenius behavior D Smirnova, S Starikov, GD Leines, Y Liang, N Wang, MN Popov, ... Physical Review Materials 4 (1), 013605, 2020 | 24 | 2020 |
| TiO 2 (100)/Al 2 O 3 (0001) interface: A first-principles study supported by experiment MN Popov, J Spitaler, M Mühlbacher, C Walter, J Keckes, C Mitterer, ... Physical Review B 86 (20), 205309, 2012 | 24 | 2012 |
| Origin of relaxor behavior in barium‐titanate‐based lead‐free perovskites V Veerapandiyan, MN Popov, F Mayer, J Spitaler, S Svirskas, V Kalendra, ... Advanced Electronic Materials 8 (2), 2100812, 2022 | 23 | 2022 |
| Point defects at the Σ5 (012)[100] grain boundary in TiN and the early stages of Cu diffusion: An ab initio study MN Popov, AS Bochkarev, VI Razumovskiy, P Puschnig, J Spitaler Acta Materialia 144, 496-504, 2018 | 20 | 2018 |
| Solute drag assessment of grain boundary migration in Au A Suhane, D Scheiber, M Popov, VI Razumovskiy, L Romaner, M Militzer Acta materialia 224, 117473, 2022 | 19 | 2022 |
| Atomistic origins of the differences in anisotropic fracture behaviour of LiTaO3 and LiNbO3 single crystals M Gruber, R Konetschnik, M Popov, J Spitaler, P Supancic, D Kiener, ... Acta Materialia 150, 373-380, 2018 | 19 | 2018 |
| Raman spectroscopy as a key method to distinguish the ferroelectric orthorhombic phase in thin ZrO2‐based films M Materano, P Reinig, A Kersch, M Popov, M Deluca, T Mikolajick, ... physica status solidi (RRL)–Rapid Research Letters, 2022 | 18 | 2022 |
| Ab initio study of Cu impurity diffusion in bulk TiN AS Bochkarev, MN Popov, VI Razumovskiy, J Spitaler, P Puschnig Physical Review B 94 (10), 104303, 2016 | 18 | 2016 |
| Raman spectra of fine-grained materials from first principles MN Popov, J Spitaler, VK Veerapandiyan, E Bousquet, J Hlinka, M Deluca npj Computational Materials 6 (1), 121, 2020 | 17 | 2020 |
| A theoretical insight into hydrogen clustering at defects in Ni S He, MN Popov, W Ecker, R Pippan, VI Razumovskiy Philosophical Magazine Letters 101 (2), 68-78, 2021 | 12 | 2021 |
| Interactions between a H2 Molecule and Carbon Nanostructures: A DFT Study D Gehringer, T Dengg, MN Popov, D Holec C 6 (1), 16, 2020 | 11 | 2020 |
| Modeling of Diffusion and Incorporation of Interstitial Oxygen Ions at the TiN/SiO2 Interface J Cottom, A Bochkarev, E Olsson, K Patel, M Munde, J Spitaler, MN Popov, ... ACS applied materials & interfaces 11 (39), 36232-36243, 2019 | 11 | 2019 |
| Calculation of the energy of binding of titanium and scandium complexes to the surface of carbon nanotubes AA Kuzubov, PO Krasnov, TA Kozhevnikov, MN Popov Russian Journal of Physical Chemistry B 3, 679-683, 2009 | 10 | 2009 |
| Peculiarities of the decoration of carbon nanotubes with transition metal atoms AA Kuzubov, PO Krasnov, TA Kozhevnikova, MN Popov, PV Artyushenko Russian Journal of Physical Chemistry B 5, 163-167, 2011 | 9 | 2011 |
| Study on Ca segregation toward an epitaxial interface between bismuth ferrite and strontium titanate U Haselmann, G Haberfehlner, W Pei, MN Popov, L Romaner, D Knez, ... ACS applied materials & interfaces 12 (10), 12264-12274, 2020 | 6 | 2020 |
| Temperature dependence of solute segregation energies at W GBs from first principles D Scheiber, MN Popov, L Romaner Scripta materialia 222, 115059, 2023 | 5 | 2023 |
Christian MittererProfessor of Functional Materials and Materials Systems, Montanuniversität Leoben, AustriaVerified email at unileoben.ac.at
