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Kretz, Bernhard; Lončarić, Ivor | Tuning Electronic Properties of Nanoporous Graphene // Inorganic chemistry, 64 (2025), 22; 11022-11031. doi: 10.1021/acs.inorgchem.5c01115
doipubs.acs.org
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Ren, Zhilin; Yuan, Zhengtian; Ovčar, Juraj; Leung, Tik Lun; He, Yanling; Ho-Baillie, Anita W.Y.; Lončarić, Ivor; Popović, Jasminka; Djurišić, Aleksandra B. | Elucidation of the suppression of photoinduced segregation in 2D mixed halide, A2PbI2Br2: Critical role of A2PbBr4 photostability // iScience (Cambridge), 28 (2025), 4; 112154, 15. doi: 10.1016/j.isci.2025.112154
doiwww.cell.comfulir.irb.hr
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Klaser, Teodoro; Popović, Jasminka; Lončarić, Ivor; Skoko, Željko | Structural Evolution Leading to the Thermosalient Phase Transition of Oxitropium Bromide // Molecules, 30 (2025), 5; 1107-1111. doi: 10.3390/molecules30051107
doiwww.mdpi.com
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Jakovac, Ivan; Cvitanić, Tonči; Arčon, Denis; Herak, Mirta; Cinčić, Dominik; Topić, Nea Baus; Hosokoshi, Yuko; Ono, Toshio; Iwashita, Ken; Hayashi, Nobuyuki et al. | Properties of an organic model S=1 Haldane chain system // Physical review. B, 111 (2025), 6; 064407, 13. doi: 10.1103/physrevb.111.064407
doilink.aps.orglink.aps.orgharvest.aps.orgfulir.irb.hr
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Stolar, Tomislav; Pearce, Ben K.D.; Etter, Martin; Truong, Khai-Nghi; Ostojić, Tea; Krajnc, Andraž; Mali, Gregor; Rossi, Barbara; Molčanov, Krešimir; Lončarić, Ivor et al. | Base-pairing of uracil and 2,6-diaminopurine: from cocrystals to photoreactivity // iScience (Cambridge), 27 (2024), 6; 109894, 13. doi: 10.1016/j.isci.2024.109894
doichemrxiv.orgfulir.irb.hrwww.sciencedirect.comdx.doi.org
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Ren, Zhilin; Ovčar, Juraj; Leung, Tik Lun; He, Yanling; Li, Yin; Li, Dongyang; Qin, Xinshun; Mo, Hongbo; Yuan, Zhengtian; Bing, Jueming et al. | Increased resistance to photooxidation in Dion-Jacobson lead halide perovskites: Implication for perovskite device stability // Matter, (2024), doi: 10.1016/j.matt.2024.11.031
doiwww.sciencedirect.comwww.cell.com
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Foretić, Blaženka; Klaser, Teodoro; Ovčar, Juraj; Lončarić, Ivor; Žilić, Dijana; Šantić, Ana; Štefanić, Zoran; Bjelopetrović, Alen; Popović, Jasminka; Picek, Igor | The reversible electron transfer within stimuli-responsive hydrochromic supramolecular material containing pyridinium oxime and hexacyanoferrate (II) ions // Molecules, 29 (2024), 23; 5611, 15. doi: 10.3390/molecules29235611
doiwww.mdpi.com
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Mladineo, Bruno; Lončarić, Ivor | Thermosalient Phase Transitions from Machine Learning Interatomic Potential // Crystal growth & design, 24 (2024), 20; 8167-8173. doi: 10.1021/acs.cgd.4c00905
doipubs.acs.orgfulir.irb.hr
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(CCDC seventh blind test of crystal structure prediction) Hunnisett, Lily M.; Francia, Nicholas; Nyman, Jonas; Abraham, Nathan S.; Aitipamula, Srinivasulu; Alkhidir, Tamador; Almehairbi, Mubarak; Anelli, Andrea; Anstine, Dylan M.; Anthony, John E. et al. | The seventh blind test of crystal structure prediction: structure ranking methods // Acta crystallographica. Section B, Structural science, crystal engineering and materials, 80 (2024), 6; 548-574. doi: 10.1107/s2052520624008679
doifulir.irb.hrjournals.iucr.org
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Žugec, Ivan ; Geilhufe, Matthias, R.; Lončarić, Ivor | Global machine learning potentials for molecular crystals // The Journal of chemical physics, 160 (2024), 15410, 7. doi: 10.1063/5.0196232
doipubs.aip.orgfulir.irb.hr
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Alić Stolar, Jasna; Lončarić, Ivor; Ettel, Martin; Rubčić, Mirta; Štefanić, Zoran; Šekutor, Marina; Užarević, Krunoslav; Stolar, Tomislav | Direct in situ measurement of polymorphic transition temperatures under thermo-mechanochemical conditions // PCCP. Physical chemistry chemical physics, 26 (2024), 6; 4840-4844. doi: 10.1039/D3CP04364A
doipubs.rsc.org
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Molčanov, Lidija; Androš Dubraja, Lidija; Žilić, Dijana; Molčanov, Krešimir; Barišić, Dario; Pajić, Damir; Lončarić, Ivor; Šantić, Ana; Jurić, Marijana | Light-Induced Intramolecular Electron Transfer in a 1D [CuFe] Coordination Polymer Containing the [Fe(C2O4)3]3– Core // Inorganic chemistry, 62 (2023), 42; 17219-17227. doi: 10.1021/acs.inorgchem.3c02351
doipubs.acs.orgfulir.irb.hr
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Lindner, Steven; Lončarić, Ivor; Vrček, Lovro; Alducin, Maite; Juaristi, J Iñaki; Saalfrank, Peter | Femtosecond laser-induced desorption of hydrogen molecules from Ru (0001): A systematic study based on machine-learned potentials // Journal of physical chemistry. C, 127 (2023), 30; 14756-14764. doi: 10.1021/acs.jpcc.3c02941
doipubs.acs.org
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Topić, Edi ; Šenjug, Pavla ; Barišić, Dario ; Lončarić, Ivor ; Pajić, Damir ; Rubčić, Mirta | Structure-Related Evolution of Magnetic Order in Anisidinium Tetrachlorocuprates(II) // Crystal growth & design, 23 (2023), 6; 4262-4272. doi: 10.1021/acs.cgd.3c00066
doipubs.acs.org
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Ovčar, Juraj ; Grisanti, Luca ; Mladineo, Bruno ; Djurišić, Aleksandra B. ; Popović, Jasminka ; Lončarić, Ivor | Crystal structure prediction of quasi-two-dimensional lead halide perovskites // Physical review. B, 107 (2023), 17; 174109, 12. doi: 10.1103/physrevb.107.174109
doijournals.aps.orgarxiv.orgfulir.irb.hr
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Lončarić, Ivor ; Alducin, Maite ; Juaristi, J. Iñaki | O2 on Ag(110): A puzzle for exchange-correlation functionals // Chemical Physics, 554 (2022), 111424, 25. doi: 10.1016/j.chemphys.2021.111424
doiwww.sciencedirect.com
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Muzas, A.S. ; Serrano Jiménez, Alfredo ; Ovčar, Juraj ; Lončarić, Ivor ; Alducin, Maite ; Juaristi, J. Iñaki | Absence of isotope effects in the photo-induced desorption of CO from saturated Pd(111) at high laser fluence // Chemical Physics, 558 (2022), 111518, 8. doi: 10.1016/j.chemphys.2022.111518
doiwww.sciencedirect.comfulir.irb.hr
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Stolar, Tomislav ; Alić, Jasna ; Lončarić, Ivor ; Etter, Martin ; Jung, Dahee ; Farha, K. Omar ; Đilović, Ivica ; Meštrović, Ernest ; Užarević, Krunoslav | Sustainable solid form screening: mechanochemical control over nucleobase hydrogen-bonded organic framework polymorphism // Crystengcomm, 24 (2022), 6505-6511. doi: 10.1039/D2CE00668E
doipubs.rsc.orgdoi.org
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Ovčar, Juraj ; Leung, Tik Lun ; Grisanti, Luca ; Skoko, Željko ; Vrankić, Martina ; Low, Kam-Hung ; Wang, Shixun ; You, Pei-Ying ; Ahn, Hyeyoung ; Lončarić, Ivor et al. | Mixed Halide Ordering as a Tool for the Stabilization of Ruddlesden–Popper Structures // Chemistry of materials, 34 (2022), 10; 4286-4297. doi: 10.1021/acs.chemmater.1c03815
doipubs.acs.orgdoi.org
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Serrano Jiménez, Alfredo ; Sánchez Muzas, Alberto P. ; Zhang, Yaolong ; Ovčar, Juraj ; Jiang, Bin ; Lončarić, Ivor ; Juaristi, J. Iñaki ; Alducin, Maite | Photoinduced Desorption Dynamics of CO from Pd(111): A Neural Network Approach // Journal of chemical theory and computation, 17 (2021), 8; 4648-4659. doi: 10.1021/acs.jctc.1c00347
doipubs.acs.orgdoi.org
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Liu, Fangzhou ; Qin, Xinshun ; Han, Bing ; Chan, Christopher C. S. ; Ma, Chao ; Leung, Tik Lun ; Chen, Wei ; He, Yanling ; Lončarić, Ivor ; Grisanti, Luca et al. | Enhanced Light Emission Performance of Mixed Cation Perovskite Films—The Effect of Solution Stoichiometry on Crystallization // Advanced optical materials, 9 (2021), 21; 2100393, 8. doi: 10.1002/adom.202100393
doionlinelibrary.wiley.comdoi.org
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Tolj, Davor ; Ivšić, Trpimir ; Živković, Ivica ; Semeniuk, Konstantin ; Martino, Edoardo ; Akrap, Ana ; Reddy, Priyanka ; Klebel-Knobloch, Benjamin ; Lončarić, Ivor ; Forró, László et al. | Synthesis of murunskite single crystals: A bridge between cuprates and pnictides // Applied materials today, 24 (2021), 101096, 9. doi: 10.1016/j.apmt.2021.101096
doiwww.sciencedirect.comdoi.orgarxiv.org
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Šenjug, Pavla ; Dragović, Jure ; Torić, Filip ; Lončarić, Ivor ; Despoja, Vito ; Smokrović, Kristina ; Topić, Edi ; Đilović, Ivica ; Rubčić, Mirta ; Pajić, Damir | Magnetoelectric Multiferroicity and Magnetic Anisotropy in Guanidinium Copper(II) Formate Crystal // Materials, 14 (2021), 7; 1730, 19. doi: 10.3390/ma14071730
doiwww.mdpi.comdoi.orgfulir.irb.hr
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Martinez, Valentina ; Karadeniz, Bahar ; Biliškov, Nikola ; Lončarić, Ivor ; Muratović, Senada ; Žilić, Dijana ; Avdoshenko, Stanislav M. ; Roslova, Maria ; Popov, Alexey A. ; Užarević, Krunoslav | Tunable Fulleretic Sodalite MOFs: Highly Efficient and Controllable Entrapment of C60 Fullerene via Mechanochemistry // Chemistry of materials, 32 (2020), 24; 10628-10640. doi: 10.1021/acs.chemmater.0c03796
doipubs.acs.orgdoi.org
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Lukin, Stipe ; Stolar, Tomislav ; Lončarić, Ivor ; Milanović, Igor ; Biliškov, Nikola ; di Michiel, Marco ; Friščić, Tomislav ; Halasz, Ivan | Mechanochemical Metathesis between AgNO3 and NaX (X = Cl, Br, I) and Ag2XNO3 Double-Salt Formation // Inorganic chemistry, 59 (2020), 17; 12200-12208. doi: 10.1021/acs.inorgchem.0c01196
doipubs.acs.org
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Chan, Christopher C. S. ; Fan, Kezhou ; Wang, Han ; Huang, Zhanfeng ; Novko, Dino ; Yan, Keyou ; Xu, Jianbin ; Choy, Wallace C. H. ; Lončarić, Ivor ; Wong, Kam Sing | Uncovering the Electron‐Phonon Interplay and Dynamical Energy‐Dissipation Mechanisms of Hot Carriers in Hybrid Lead Halide Perovskites // Advanced Energy Materials, 11 (2021), 9; 202003071, 10. doi: 10.1002/aenm.202003071
doidoi.orgonlinelibrary.wiley.comfulir.irb.hr
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Kanižaj, Lidija ; Barišić, Dario ; Torić, Filip ; Pajić, Damir ; Molčanov, Krešimir ; Šantić, Ana ; Lončarić, Ivor ; Jurić, Marijana | Structural, Electrical, and Magnetic Versatility of the Oxalate-Based [CuFe] Compounds Containing 2,2′:6′,2″-Terpyridine: Anion-Directed Synthesis // Inorganic chemistry, 59 (2020), 24; 18078-18089. doi: 10.1021/acs.inorgchem.0c02548
doipubs.acs.orgdoi.org
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Bosnar, Mihovil ; Caciuc, Vasile ; Atodiresei, Nicolae ; Lončarić, Ivor ; Blügel, Stefan | Se intercalation between PtSe2 and the Pt surface during synthesis of PtSe2 by direct selenization of Pt(111) // Physical review. B, 102 (2020), 11; 115427, 7. doi: 10.1103/physrevb.102.115427
doijournals.aps.orgfulir.irb.hr
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Bosnar, Mihovil ; Lončarić, Ivor ; Lazić, Predrag ; Belashchenko, Kiril D. ; Žutić, Igor | Proximity-induced magnetization in graphene: Towards efficient spin gating // Physical review materials, 4 (2020), 11; 114006, 9. doi: 10.1103/physrevmaterials.4.114006
doijournals.aps.orgarxiv.org
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Tam, Ho Won ; Leung, Tik Lun ; Sun, Wenting ; Liu, Fangzhou ; Ma, Chao ; Kam, Chun Sing ; Lončarić, Ivor ; Grisanti, Luca ; Ovčar, Juraj ; Skoko, Željko et al. | Phase control for quasi-2D blue emitters by spacer cation engineering // Journal of Materials Chemistry C, 8 (2020), 11052-11060. doi: 10.1039/d0tc01631d
doipubs.rsc.orgdoi.orgfulir.irb.hr
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Yuan, Yusheng ; Sheng, Kai ; Zeng, Suyuan ; Han, Xiguang ; Sun, Liming ; Lončarić, Ivor ; Zhan, Wenwen ; Sun, Di | Engineering Cu/TiO2@N-Doped C Interfaces Derived from an Atom-Precise Heterometallic CuII4TiIV5 Cluster for Efficient Photocatalytic Hydrogen Evolution // Inorganic chemistry, 59 (2020), 8; 5456-5462. doi: 10.1021/acs.inorgchem.0c00084
doipubs.acs.orgdoi.orgfulir.irb.hr
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Leung, Tik Lun ; Tam, Ho Won ; Liu, Fangzhou ; Lin, Jingyang ; Ng, Alan Man Ching ; Chan, Wai Kin ; Chen, Wei ; He, Zhubing ; Lončarić, Ivor ; Grisanti, Luca et al. | Mixed Spacer Cation Stabilization of Blue‐Emitting n = 2 Ruddlesden–Popper Organic–Inorganic Halide Perovskite Films // Advanced optical materials, 8 (2019), 4; 1901679, 11. doi: 10.1002/adom.201901679
doionlinelibrary.wiley.comdoi.orgfulir.irb.hr
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Scholz, Robert ; Lindner, Steven ; Lončarić, Ivor ; Tremblay, Jean Christophe ; Juaristi, J. I. ; Alducin, M. ; Saalfrank, Peter | Vibrational response and motion of carbon monoxide on Cu(100) driven by femtosecond laser pulses: Molecular dynamics with electronic friction // Physical review. B, 100 (2019), 24; 245431, 20. doi: 10.1103/physrevb.100.245431
doijournals.aps.orgdoi.org
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Karadeniz, Bahar ; Žilić, Dijana ; Huskić, Igor ; Germann, Luzia S. ; Fidelli, Athena M. ; Muratović, Senada ; Lončarić, Ivor ; Etter, Martin ; Dinnebier, Robert E. ; Barišić, Dajana et al. | Controlling the Polymorphism and Topology Transformation in Porphyrinic Zirconium Metal– Organic Frameworks via Mechanochemistry // Journal of the American Chemical Society, 141 (2019), 49; 19214-19120. doi: 10.1021/jacs.9b10251
doipubs.acs.orgdoi.org
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Mervinetsky, Evgeniy ; Alshanski, Israel ; Buchwald, Jörg ; Dianat, Arezoo ; Lončarić, Ivor ; Lazić, Predrag ; Crljen, Željko ; Gutierrez, Rafael ; Cuniberti, Gianaurelio ; Hurevich, Mattan et al. | Direct Assembly and Metal-Ion Binding Properties of Oxytocin Monolayer on Gold Surfaces // Langmuir, 35 (2019), 34; 11114-11122. doi: 10.1021/acs.langmuir.9b01830
doipubs.acs.orgdoi.org
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Despoja, Vito ; Novko, Dino ; Lončarić, Ivor ; Golenić, Neven ; Marušić, Leonardo ; Silkin, Vyacheslav M. | Strong acoustic plasmons in chemically doped graphene induced by a nearby metal surface // Physical review. B, 100 (2019), 19; 195401, 8. doi: 10.1103/physrevb.100.195401
doijournals.aps.orgdoi.orgfulir.irb.hr
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Kanižaj, Lidija ; Molčanov, Krešimir ; Torić, Filip ; Pajić, Damir ; Lončarić, Ivor ; Šantić, Ana ; Jurić, Marijana | Ladder-like [CrCu] coordination polymers containing unique bridging modes of [Cr(C2O4)3]3− and Cr2O72− // Dalton transactions, 48 (2019), 7891-7898. doi: 10.1039/C9DT01195A
doipubs.rsc.org
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Pecqueur, Sébastien ; Lončarić, Ivor ; Zlatić, Vinko ; Vuillaume, Dominique ; Crljen, Željko | The non-ideal organic electrochemical transistors impedance // Organic electronics, 71 (2019), 14-23. doi: 10.1016/j.orgel.2019.05.001
doiwww.sciencedirect.comdoi.org
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Lončarić, Ivor ; Alducin, M. ; Juaristi, J. I. ; Novko, Dino | CO Stretch Vibration Lives Long on Au(111) // Journal of physical chemistry letters, 10 (2019), 5; 1043-1047. doi: 10.1021/acs.jpclett.9b00069
doipubs.acs.orgfulir.irb.hr
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Lukin, Stipe ; Tireli, Martina ; Lončarić, Ivor ; Barišić, Dajana ; Šket, Primož ; Vrsaljko, Domagoj ; di Michiel, Marco ; Plavec, Janez ; Užarević, Krunoslav ; Halasz, Ivan | Mechanochemical carbon-carbon bond formation that proceeds via a cocrystal intermediate // Chemical communications, 54 (2018), 13216-13219. doi: 10.1039/C8CC07853J
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Lončarić, Ivor ; Rukelj, Zoran ; Silkin, Vyacheslav M. ; Despoja, Vito | Strong two-dimensional plasmon in Li-intercalated hexagonal boron-nitride film with low damping // npj 2D materials and applications, 2 (2018), 1; 33, 7. doi: 10.1038/s41699-018-0078-y
doiwww.nature.com
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Lončarić, Ivor ; Alducin, M. ; Juaristi, J. I. | Dissociative dynamics of O2 on Ag(110) // PCCP. Physical chemistry chemical physics, 17 (2015), 14; 9436-9445. doi: 10.1039/c4cp05900j
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Lončarić, Ivor ; Alducin, Maite ; Saalfrank, Peter ; Juaristi, J. Iñaki | Femtosecond laser pulse induced desorption: A molecular dynamics simulation // Nuclear instruments & methods in physics research. Section B, Beam interactions with materials and atoms, 382 (2016), 114-118. doi: 10.1016/j.nimb.2016.02.051
doiwww.sciencedirect.com
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Scholz, Robert ; Floß, Gereon ; Saalfrank, Peter ; Füchsel, Gernot ; Lončarić, Ivor ; Juaristi, J. I. | Femtosecond-laser induced dynamics of CO on Ru(0001): Deep insights from a hot-electron friction model including surface motion // Physical review. B, 94 (2016), 16; 165447, 17. doi: 10.1103/physrevb.94.165447
doijournals.aps.org
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Novko, Dino ; Lončarić, Ivor ; Blanco-Rey, María ; Juaristi, J. Iñaki ; Alducin, Maite | Energy loss and surface temperature effects in ab initio molecular dynamics simulations: N adsorption on Ag(111) as a case study // Physical review. B, 96 (2017), 8; 085437, 8. doi: 10.1103/physrevb.96.085437
doijournals.aps.org
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Lončarić, Ivor ; Füchsel, Gernot ; Juaristi, J. I. ; Saalfrank, Peter | Strong Anisotropic Interaction Controls Unusual Sticking and Scattering of CO at Ru(0001) // Physical review letters, 119 (2017), 14; 146101, 5. doi: 10.1103/physrevlett.119.146101
doijournals.aps.org
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Feng, Jiandong ; Deschout, Hendrik ; Caneva, Sabina ; Hofmann, Stephan ; Lončarić, Ivor ; Lazić, Predrag ; Radenovic, Aleksandra | Imaging of Optically Active Defects with Nanometer Resolution // Nano letters, 18 (2018), 3; 1739-1744. doi: 10.1021/acs.nanolett.7b04819
doipubs.acs.org
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Lončarić, Ivor ; Alducin, M. ; Juaristi, J. I. | Molecular dynamics simulation of O2 adsorption on Ag(110) from first principles electronic structure calculations // PCCP. Physical chemistry chemical physics, 18 (2016), 39; 27366-27376. doi: 10.1039/c6cp05199e
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Lončarić, Ivor ; Alducin, M. ; Saalfrank, P. ; Juaristi, J. I. | Femtosecond-laser-driven molecular dynamics on surfaces: Photodesorption of molecular oxygen from Ag(110) // Physical review. B, 93 (2016), 1; 014301, 9. doi: 10.1103/physrevb.93.014301
doijournals.aps.org
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Jurić, Marijana ; Androš Dubraja, Lidija ; Popović, Jasminka ; Molčanov, Krešimir ; Torić, Filip ; Pajić, Damir ; Lončarić, Ivor | From a square core to square opening: structural diversity and magnetic properties of the oxo-bridged [CrIIINbV] complexes // Dalton transactions, 47 (2018), 12; 4183-4190. doi: 10.1039/C7DT04724J
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Lukin, Stipe ; Lončarić, Ivor ; Tireli, Martina ; Stolar, Tomislav ; Blanco, Maria V. ; Lazić, Predrag ; Užarević, Krunoslav ; Halasz, Ivan. | Experimental and Theoretical Study of Selectivity in Mechanochemical Cocrystallization of Nicotinamide with Anthranilic and Salicylic Acid // Crystal growth & design, 18 (2018), 3; 1539-1547. doi: 10.1021/acs.cgd.7b01512
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Lončarić, Ivor ; Popović, Jasminka ; Despoja, Vito ; Burazer, Sanja ; Grgičević, Ivan ; Popović, Dean ; Skoko, Željko | Reversible Thermosalient Effect of N′-2- Propylidene-4-hydroxybenzohydrazide Accompanied by an Immense Negative Compressibility: Structural and Theoretical Arguments Aiming toward the Elucidation of Jumping Phenomenon // Crystal growth & design, 17 (2017), 8; 4445-4453. doi: 10.1021/acs.cgd.7b00785
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Lončarić, Ivor ; Despoja, Vito | Benchmarking van der Waals functionals with noncontact RPA calculations on graphene-Ag(111) // Physical review. B, Condensed matter and materials physics, 90 (2014), 075414, 7. doi: 10.1103/PhysRevB.90.075414
doijournals.aps.orgdx.doi.org
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Despoja, Vito ; Lončarić, Ivor ; Mowbray, Duncan ; Marušić, Leonardo | Quasiparticle spectra and excitons of organic molecules deposited on substrates: G 0 W0 -BSE approach applied to benzene on graphene and metallic substrates // Physical review. B, Condensed matter and materials physics, 88 (2013), 235437, 9. doi: 10.1103/PhysRevB.88.235437
doijournals.aps.orgdx.doi.org
