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  Author Title Year Publication (up) Volume Times cited Additional Links Links
Michel, K.H.; Verberck, B.; Hulman, M.; Kuzmany, H.; Krause, M. Superposition of quantum and classical rotational motions in Sc2C2@C84 fullerite 2007 The journal of chemical physics 126 14 UA library record; WoS full record; WoS citing articles doi
Verberck, B.; Popov, V.N.; Nikolaev, A.V.; Lamoen, D. Valence electronic charge density of distorted C60-monomers in polymerized KC60 and RbC60 2004 The journal of chemical physics 121 7 UA library record; WoS full record; WoS citing articles doi
Nikolaev, A.V.; Lamoen, D.; Partoens, B. Extension of the basis set of linearized augmented plane wave (LAPW) method by using supplemented tight binding basis functions 2016 The journal of chemical physics 145 11 UA library record; WoS full record; WoS citing articles pdf url doi
Kandemir, A.; Peeters, F.M.; Sahin, H. Monitoring the effect of asymmetrical vertical strain on Janus single layers of MoSSe via spectrum 2018 The journal of chemical physics 149 11 UA library record; WoS full record; WoS citing articles pdf doi
Demiroglu, I.; Peeters, F.M.; Gulseren, O.; Cakir, D.; Sevik, C. Alkali metal intercalation in MXene/graphene heterostructures : a new platform for ion battery applications 2019 The journal of physical chemistry letters 10 67 UA library record; WoS full record; WoS citing articles doi
Javdani, Z.; Hassani, N.; Faraji, F.; Zhou, R.; Sun, C.; Radha, B.; Neyts, E.; Peeters, F.M.; Neek-Amal, M. Clogging and unclogging of hydrocarbon-contaminated nanochannels 2022 The journal of physical chemistry letters 13 UA library record; WoS full record pdf url doi
Alihosseini, M.; Ghasemi, S.; Ahmadkhani, S.; Alidoosti, M.; Esfahani, D.N.; Peeters, F.M.; Neek-Amal, M. Electronic properties of oxidized graphene : effects of strain and an electric field on flat bands and the energy gap 2021 The journal of physical chemistry letters 1 UA library record; WoS full record; WoS citing articles pdf doi
Kocabas, T.; Ozden, A.; Demiroglu, I.; Cakir, D.; Sevik, C. Determination of Dynamically Stable Electrenes toward Ultrafast Charging Battery Applications 2018 The journal of physical chemistry letters 9 UA library record; WoS full record; WoS citing articles doi
Mazzola, F.; Hassani, H.; Amoroso, D.; Chaluvadi, S.K.; Fujii, J.; Polewczyk, V.; Rajak, P.; Koegler, M.; Ciancio, R.; Partoens, B.; Rossi, G.; Vobornik, I.; Ghosez, P.; Orgiani, P. Unveiling the electronic structure of pseudotetragonal WO₃ thin films 2023 The journal of physical chemistry letters 14 UA library record; WoS full record url doi
Neek-Amal, M.; Beheshtian, J.; Sadeghi, A.; Michel, K.H.; Peeters, F.M. Boron nitride mono layer : a strain-tunable nanosensor 2013 The journal of physical chemistry: C : nanomaterials and interfaces 117 38 UA library record; WoS full record; WoS citing articles doi
Wendelen, W.; Dzhurakhalov, A.A.; Peeters, F.M.; Bogaerts, A. Combined molecular dynamics: continuum study of phase transitions in bulk metals under ultrashort pulsed laser irradiation 2010 The journal of physical chemistry: C : nanomaterials and interfaces 114 2 UA library record; WoS full record; WoS citing articles pdf doi
de Oliveira, E.L.; Albuquerque, E.L.; de Sousa, J.S.; Farias, G.A.; Peeters, F.M. Configuration-interaction excitonic absorption in small Si/Ge and Ge/Si core/shell nanocrystals 2012 The journal of physical chemistry: C : nanomaterials and interfaces 116 44 UA library record; WoS full record; WoS citing articles doi
Ao, Z.M.; Peeters, F.M. Electric field activated hydrogen dissociative adsorption to nitrogen-doped graphene 2010 The journal of physical chemistry: C : nanomaterials and interfaces 114 110 UA library record; WoS full record; WoS citing articles doi
Sivek, J.; Leenaerts, O.; Partoens, B.; Peeters, F.M. First-principles investigation of bilayer fluorographene 2012 The journal of physical chemistry: C : nanomaterials and interfaces 116 39 UA library record; WoS full record; WoS citing articles doi
Amini, M.N.; Leenaerts, O.; Partoens, B.; Lamoen, D. Graphane- and fluorographene-based quantum dots 2013 The journal of physical chemistry: C : nanomaterials and interfaces 117 14 UA library record; WoS full record; WoS citing articles pdf doi
Nicholls, D.; Li, R.R.; Ware, B.; Pansegrau, C.; Çakir, D.; Hoffmann, M.R.; Oncel, N. Scanning tunneling microscopy and density functional theory study on zinc(II)-phthalocyanine tetrasulfonic acid on bilayer epitaxial graphene on silicon carbide(0001) 2015 The journal of physical chemistry: C : nanomaterials and interfaces 119 3 UA library record; WoS full record; WoS citing articles doi
Esfahani; Leenaerts, O.; Sahin, H.; Partoens, B.; Peeters, F.M. Structural transitions in monolayer MOS2 by lithium adsorption 2015 The journal of physical chemistry: C : nanomaterials and interfaces 119 96 UA library record; WoS full record; WoS citing articles doi
Kang, J.; Sahin, H.; Peeters, F.M. Tuning carrier confinement in the MoS2/WS2 lateral heterostructure 2015 The journal of physical chemistry: C : nanomaterials and interfaces 119 73 UA library record; WoS full record; WoS citing articles doi
Iyikanat, F.; Sahin, H.; Senger, R.T.; Peeters, F.M. Vacancy formation and oxidation characteristics of single layer TiS3 2015 The journal of physical chemistry: C : nanomaterials and interfaces 119 51 UA library record; WoS full record; WoS citing articles doi
Alyörük, M.M.; Aierken, Y.; Çakır, D.; Peeters, F.M.; Sevik, C. Promising Piezoelectric Performance of Single Layer Transition-Metal Dichalcogenides and Dioxides 2015 The journal of physical chemistry: C : nanomaterials and interfaces 119 134 UA library record; WoS full record; WoS citing articles pdf url doi
Sevik, C.; Çakir, D.; Gulseren, O.; Peeters, F.M. Peculiar piezoelectric properties of soft two-dimensional materials 2016 The journal of physical chemistry: C : nanomaterials and interfaces 120 39 UA library record; WoS full record; WoS citing articles url doi
Singh, S.K.; Costamagna, S.; Neek-Amal, M.; Peeters, F.M. Melting of partially fluorinated graphene : from detachment of fluorine atoms to large defects and random coils 2014 The journal of physical chemistry: C : nanomaterials and interfaces 118 16 UA library record; WoS full record; WoS citing articles doi
Kus, M.; Altantzis, T.; Vercauteren, S.; Caretti, I.; Leenaerts, O.; Batenburg, K.J.; Mertens, M.; Meynen, V.; Partoens, B.; Van Doorslaer, S.; Bals, S.; Cool, P. Mechanistic Insight into the Photocatalytic Working of Fluorinated Anatase {001} Nanosheets 2017 The journal of physical chemistry: C : nanomaterials and interfaces 121 20 UA library record; WoS full record; WoS citing articles pdf url doi
Bafekry, A.; Shayesteh, S.F.; Peeters, F.M. C3N Monolayer: Exploring the Emerging of Novel Electronic and Magnetic Properties with Adatom Adsorption, Functionalizations, Electric Field, Charging, and Strain 2019 The journal of physical chemistry: C : nanomaterials and interfaces 123 67 UA library record; WoS full record; WoS citing articles url doi
Badalov, S.V.; Yagmurcukardes, M.; Peeters, F.M.; Sahin, H. Enhanced stability of single-layer w-Gallenene through hydrogenation 2018 The journal of physical chemistry: C : nanomaterials and interfaces 122 20 UA library record; WoS full record; WoS citing articles url doi
Kahraman, Z.; Kandemir, A.; Yagmurcukardes, M.; Sahin, H. Single-layer Janus-type platinum dichalcogenides and their heterostructures 2019 The journal of physical chemistry: C : nanomaterials and interfaces 123 20 UA library record; WoS full record; WoS citing articles url doi
Eren, I.; Ozen, S.; Sozen, Y.; Yagmurcukardes, M.; Sahin, H. Vertical van der Waals heterostructure of single layer InSe and SiGe 2019 The journal of physical chemistry: C : nanomaterials and interfaces 123 UA library record; WoS full record; WoS citing articles url doi
Bussmann-Holder, A.; Dalal, N.; Michel, K.H. Polarizability induced cooperative proton ordering, coexistence of order/disorder and displacive dynamics and isotope effects in hydrogen-bonded systems 2000 The journal of physics and chemistry of solids T2 – Williamsburg Workshop on Ferroelectrics 99, JAN 31-FEB 03, 1999, WILLIAMSBURG, VIRGINIA 61 8 UA library record; WoS full record; WoS citing articles pdf doi
Saniz, R.; Xu, Y.; Matsubara, M.; Amini, M.N.; Dixit, H.; Lamoen, D.; Partoens, B. A simplified approach to the band gap correction of defect formation energies : Al, Ga, and In-doped ZnO 2013 The journal of physics and chemistry of solids 74 36 UA library record; WoS full record; WoS citing articles pdf doi
Saniz, R.; Sarmadian, N.; Partoens, B.; Batuk, M.; Hadermann, J.; Marikutsa, A.; Rumyantseva, M.; Gaskov, A.; Lamoen, D. First-principles study of CO and OH adsorption on in-doped ZnO surfaces 2019 The journal of physics and chemistry of solids 132 7 UA library record; WoS full record; WoS citing articles pdf url doi
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