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  Author Title Year (down) Publication Volume Times cited Additional Links Links
Bafekry, A.; Karbasizadeh, S.; Stampfl, C.; Faraji, M.; Hoat, D.M.; Sarsari, I.A.; Feghhi, S.A.H.; Ghergherehchi, M. Two-dimensional Janus semiconductor BiTeCl and BiTeBr monolayers : a first-principles study on their tunable electronic properties via an electric field and mechanical strain 2021 Physical Chemistry Chemical Physics 23 UA library record; WoS full record; WoS citing articles url doi
Baskurt, M.; Nair, R.R.; Peeters, F.M.; Sahin, H. Ultra-thin structures of manganese fluorides : conversion from manganese dichalcogenides by fluorination 2021 Physical Chemistry Chemical Physics 23 1 UA library record; WoS full record; WoS citing articles pdf doi
Sozen, Y.; Yagmurcukardes, M.; Sahin, H. Vibrational and optical identification of GeO₂ and GeO single layers : a first-principles study 2021 Physical Chemistry Chemical Physics 23 UA library record; WoS full record; WoS citing articles doi
Shi, W.; Pandey, T.; Lindsay, L.; Woods, L.M. Vibrational properties and thermal transport in quaternary chalcogenides : the case of Te-based compositions 2021 Physical review materials 5 UA library record; WoS full record; WoS citing articles doi
Tiwari, S.; Van de Put, M.L.; Sorée, B.; Vandenberghe, W.G. Ab initio modeling of few-layer dilute magnetic semiconductors 2021 International Conference on Simulation of Semiconductor Processes and Devices : [proceedings] T2 – International Conference on Simulation of Semiconductor Processes and, Devices (SISPAD), SEP 27-29, 2021, Dallas, TX UA library record; WoS full record pdf doi
Scolfaro, D.; Finamor, M.; Trinchao, L.O.; Rosa, B.L.T.; Chaves, A.; Santos, P., V.; Iikawa, F.; Couto, O.D.D., Jr. Acoustically driven stark effect in transition metal dichalcogenide monolayers 2021 Acs Nano 15 UA library record; WoS full record; WoS citing articles url doi
Lee, Y.; Forte, J.D.'arf S.; Chaves, A.; Kumar, A.; Tran, T.T.; Kim, Y.; Roy, S.; Taniguchi, T.; Watanabe, K.; Chernikov, A.; Jang, J.I.; Low, T.; Kim, J. Boosting quantum yields in two-dimensional semiconductors via proximal metal plates 2021 Nature Communications 12 UA library record; WoS full record; WoS citing articles url doi
Demiroglu, I.; Karaaslan, Y.; Kocabas, T.; Keceli, M.; Vazquez-Mayagoitia, A.; Sevik, C. Computation of the thermal expansion coefficient of graphene with Gaussian approximation potentials 2021 Journal Of Physical Chemistry C 125 UA library record; WoS full record; WoS citing articles pdf url doi
Demiroglu, I.; Sevik, C. Extraordinary negative thermal expansion of two-dimensional nitrides : a comparative ab initio study of quasiharmonic approximation and molecular dynamics simulations 2021 Physical Review B 103 UA library record; WoS full record; WoS citing articles url doi
Kocabas, T.; Cakir, D.; Sevik, C. First-principles discovery of stable two-dimensional materials with high-level piezoelectric response 2021 Journal Of Physics-Condensed Matter 33 UA library record; WoS full record; WoS citing articles doi
Karaaslan, Y.; Haskins, J.B.; Yapicioglu, H.; Sevik, C. Influence of randomly distributed vacancy defects on thermal transport in two-dimensional group-III nitrides 2021 Journal Of Applied Physics 129 UA library record; WoS full record; WoS citing articles doi
Saiz, F.; Karaaslan, Y.; Rurali, R.; Sevik, C. Interatomic potential for predicting the thermal conductivity of zirconium trisulfide monolayers with molecular dynamics 2021 Journal Of Applied Physics 129 UA library record; WoS full record; WoS citing articles url doi
Korkmaz, Y.A.; Bulutay, C.; Sevik, C. k · p parametrization and linear and circular dichroism in strained monolayer (Janus) transition metal dichalcogenides from first-principles 2021 Journal Of Physical Chemistry C 125 UA library record; WoS full record; WoS citing articles pdf url doi
Sun, J.; Li, Y.; Karaaslan, Y.; Sevik, C.; Chen, Y. Misfit dislocation structure and thermal boundary conductance of GaN/AlN interfaces 2021 Journal Of Applied Physics 130 UA library record; WoS full record; WoS citing articles doi
Wang, F.; Wang, C.; Chaves, A.; Song, C.; Zhang, G.; Huang, S.; Lei, Y.; Xing, Q.; Mu, L.; Xie, Y.; Yan, H. Prediction of hyperbolic exciton-polaritons in monolayer black phosphorus 2021 Nature Communications 12 UA library record; WoS full record; WoS citing articles doi
Bulut, P.; Beceren, B.; Yildirim, S.; Sevik, C.; Gurel, T. Promising room temperature thermoelectric conversion efficiency of zinc-blende AgI from first principles 2021 Journal Of Physics-Condensed Matter 33 UA library record; WoS full record doi
Chaves, A.; Sousa, G.O.; Khaliji, K.; da Costa, D.R.; Farias, G.A.; Low, T. Signatures of subband excitons in few-layer black phosphorus 2021 Physical Review B 103 UA library record; WoS full record; WoS citing articles url doi
Bafekry, A.; Stampfl, C.; Shayesteh, S.F. A first-principles study of C3N nanostructures : control and engineering of the electronic and magnetic properties of nanosheets, tubes and ribbons 2020 Chemphyschem 21 27 UA library record; WoS full record; WoS citing articles pdf url doi
Bafekry, A.; Stampfl, C.; Ghergherehchi, M.; Shayesteh, S.F. A first-principles study of the effects of atom impurities, defects, strain, electric field and layer thickness on the electronic and magnetic properties of the C2N nanosheet 2020 Carbon 157 49 UA library record; WoS full record; WoS citing articles pdf url doi
Ozcan, M.; Ozen, S.; Yagmurcukardes, M.; Sahin, H. Structural, electronic and vibrational properties of ultra-thin octahedrally coordinated structure of EuO2 2020 Journal Of Magnetism And Magnetic Materials 493 1 UA library record; WoS full record; WoS citing articles pdf doi
Gonzalez-Garcia, A.; Lopez-Perez, W.; Gonzalez-Hernandez, R.; Rivera-Julio, J.; Espejo, C.; Milošević, M.V.; Peeters, F.M. Two-dimensional hydrogenated buckled gallium arsenide: an ab initio study 2020 Journal Of Physics-Condensed Matter 32 UA library record; WoS full record pdf url doi
Marchetti, A.; Saniz, R.; Krishnan, D.; Rabbachin, L.; Nuyts, G.; De Meyer, S.; Verbeeck, J.; Janssens, K.; Pelosi, C.; Lamoen, D.; Partoens, B.; De Wael, K. Unraveling the Role of Lattice Substitutions on the Stabilization of the Intrinsically Unstable Pb2Sb2O7Pyrochlore: Explaining the Lightfastness of Lead Pyroantimonate Artists’ Pigments 2020 Chemistry Of Materials 32 8 UA library record; WoS full record; WoS citing articles pdf url doi
Bafekry, A.; Stampfl, C.; Ghergherehchi, M. Strain, electric-field and functionalization induced widely tunable electronic properties in MoS2/BC3, /C3N and / C3N4 van der Waals heterostructures 2020 Nanotechnology (Bristol. Print) 19 UA library record; WoS full record; WoS citing articles pdf url doi
Vanherck, J.; Bacaksiz, C.; Sorée, B.; Milošević, M.V.; Magnus, W. 2D ferromagnetism at finite temperatures under quantum scrutiny 2020 Applied Physics Letters 117 8 UA library record; WoS full record; WoS citing articles pdf doi
Sabani, D.; Bacaksiz, C.; Milošević, M.V. Ab initio methodology for magnetic exchange parameters: Generic four-state energy mapping onto a Heisenberg spin Hamiltonian 2020 Physical Review B 102 13 UA library record; WoS full record; WoS citing articles url doi
Siriwardane, E.M.D.; Demiroglu, I.; Sevik, C.; Peeters, F.M.; Çakir, D. Assessment of sulfur-functionalized MXenes for li-ion battery applications 2020 Journal Of Physical Chemistry C 124 15 UA library record; WoS full record; WoS citing articles pdf url doi
Topalovic, D.B.; Arsoski, V.V.; Tadic, M.Z.; Peeters, F.M. Asymmetric versus symmetric HgTe/CdxHg1-x Te double quantum wells: Bandgap tuning without electric field 2020 Journal Of Applied Physics 128 3 UA library record; WoS full record; WoS citing articles pdf doi
Devolder, T.; Bultynck, O.; Bouquin, P.; Nguyen, V.D.; Rao, S.; Wan, D.; Sorée, B.; Radu, I.P.; Kar, G.S.; Couet, S. Back hopping in spin transfer torque switching of perpendicularly magnetized tunnel junctions 2020 Physical Review B 102 UA library record; WoS full record; WoS citing articles url doi
Chaves, A.; Azadani, J.G.; Alsalman, H.; da Costa, D.R.; Frisenda, R.; Chaves, A.J.; Song, S.H.; Kim, Y.D.; He, D.; Zhou, J.; Castellanos-Gomez, A.; Peeters, F.M.; Liu, Z.; Hinkle, C.L.; Oh, S.-H.; Ye, P.D.; Koester, S.J.; Lee, Y.H.; Avouris, P.; Wang, X.; Low, T. Bandgap engineering of two-dimensional semiconductor materials 2020 npj 2D Materials and Applications 4 329 UA library record; WoS full record; WoS citing articles url doi
McNaughton, B.; Milošević, M.V.; Perali, A.; Pilati, S. Boosting Monte Carlo simulations of spin glasses using autoregressive neural networks 2020 Physical Review E 101 15 UA library record; WoS full record; WoS citing articles url doi
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