Publications | Modelling and Theory of Materialshttps://mtm.irb.hr/publication/PublicationsHugo Blox Builder (https://hugoblox.com)en-usWed, 21 Oct 2026 00:00:00 +0000https://mtm.irb.hr/media/logo.svgPublicationshttps://mtm.irb.hr/publication/Orbitol: Crystal Generation on Wyckoff Orbitshttps://mtm.irb.hr/publication/zugec-2026-orbitol/Wed, 21 Oct 2026 00:00:00 +0000https://mtm.irb.hr/publication/zugec-2026-orbitol/Defect engineering in layered MPS3 (M: Fe, Co, and Ni) materials probed by in situ X-ray spectroscopyhttps://mtm.irb.hr/publication/guo-2026-defect/Wed, 02 Sep 2026 00:00:00 +0000https://mtm.irb.hr/publication/guo-2026-defect/Site-Selective Electron Doping and Emerging Ferrimagnetism in K-Intercalated Layered CoPS3 without Metallizationhttps://mtm.irb.hr/publication/dedkov-2026-site/Sat, 29 Aug 2026 00:00:00 +0000https://mtm.irb.hr/publication/dedkov-2026-site/Electron-Phonon-Driven Temperature-Adaptive Optoelectronics in the van der Waals Ferroelectric SnP2S6https://mtm.irb.hr/publication/malkoc-2026-electron/Fri, 14 Aug 2026 00:00:00 +0000https://mtm.irb.hr/publication/malkoc-2026-electron/2026 Roadmap on Digitalising Materials Sciencehttps://mtm.irb.hr/publication/rossi-2026-roadmap/Fri, 24 Jul 2026 00:00:00 +0000https://mtm.irb.hr/publication/rossi-2026-roadmap/Dyna-Mat: End-to-end benchmarking of foundation machine learning interatomic potentials in finite-temperature ensembleshttps://mtm.irb.hr/publication/gawkowski-2026-dyna-mat/Fri, 03 Jul 2026 00:00:00 +0000https://mtm.irb.hr/publication/gawkowski-2026-dyna-mat/Janus Engineering of Polar Magnetism and Valley Splitting in CuCrP2X6 (X: S, Se) Monolayershttps://mtm.irb.hr/publication/voloshina-2026-janus/Thu, 11 Jun 2026 00:00:00 +0000https://mtm.irb.hr/publication/voloshina-2026-janus/Journal research data policies in materials sciencehttps://mtm.irb.hr/publication/hormann-2026-research-data/Mon, 08 Jun 2026 00:00:00 +0000https://mtm.irb.hr/publication/hormann-2026-research-data/Fluctuation-driven multi-step charge density wave melting in monolayer TiSe₂https://mtm.irb.hr/publication/benic-2026-fluctuation/Wed, 22 Apr 2026 00:00:00 +0000https://mtm.irb.hr/publication/benic-2026-fluctuation/Crystalite: A Lightweight Transformer for Efficient Crystal Modelinghttps://mtm.irb.hr/publication/veljkovic-2026-crystalite/Thu, 02 Apr 2026 00:00:00 +0000https://mtm.irb.hr/publication/veljkovic-2026-crystalite/Substrate-induced magnetism in graphene: a minireviewhttps://mtm.irb.hr/publication/voloshina-2026-substrate/Mon, 02 Mar 2026 00:00:00 +0000https://mtm.irb.hr/publication/voloshina-2026-substrate/Perspectives on the application of layered MPX3 materials (M: transition metal, X: chalcogen) in confined catalysis and energy applicationshttps://mtm.irb.hr/publication/guo-2026-perspectives/Mon, 19 Jan 2026 00:00:00 +0000https://mtm.irb.hr/publication/guo-2026-perspectives/BEST-CSP Benchmark Study of Polymorphs I and II of Sulfamerazine and the Perils of Polytype Polymorphshttps://mtm.irb.hr/publication/wood-2026-best-csp/Wed, 07 Jan 2026 00:00:00 +0000https://mtm.irb.hr/publication/wood-2026-best-csp/Synthesis of graphene layers on polycrystalline Ni foil using liquid ethanolhttps://mtm.irb.hr/publication/zhou-2025-synthesis/Fri, 05 Dec 2025 00:00:00 +0000https://mtm.irb.hr/publication/zhou-2025-synthesis/Modulating magnetism in layered hybrid Halocuprates (II): The role of constituting ionshttps://mtm.irb.hr/publication/topic-2025-modulating/Mon, 01 Dec 2025 00:00:00 +0000https://mtm.irb.hr/publication/topic-2025-modulating/Atomic structure and quasiparticle interference of epitaxial graphene on ferromagnetic Mn5Ge3https://mtm.irb.hr/publication/enenkel-2025-atomic/Mon, 20 Oct 2025 00:00:00 +0000https://mtm.irb.hr/publication/enenkel-2025-atomic/Europium intercalation as a route to modulate electronic and magnetic properties of h-BN/Ni(111)https://mtm.irb.hr/publication/voloshina-2025-europium/Fri, 17 Oct 2025 00:00:00 +0000https://mtm.irb.hr/publication/voloshina-2025-europium/Photoinduced frustration modulation in $kappa$-type quantum spin liquid candidateshttps://mtm.irb.hr/publication/tepie-2025-photoinduced/Wed, 08 Oct 2025 00:00:00 +0000https://mtm.irb.hr/publication/tepie-2025-photoinduced/Illustrating Extreme Negative Linear Compressibility in Thermosalient Molecular Crystalshttps://mtm.irb.hr/publication/mladineo-2025-illustrating/Mon, 22 Sep 2025 00:00:00 +0000https://mtm.irb.hr/publication/mladineo-2025-illustrating/Beyond pristine layers: Engineering van der Waals MPX3 materials (M: Transition Metal, X: Chalcogen) via defects, adsorption, and intercalationhttps://mtm.irb.hr/publication/dedkov-2025-beyond/Wed, 20 Aug 2025 00:00:00 +0000https://mtm.irb.hr/publication/dedkov-2025-beyond/Machine learning model for efficient nonthermal tuning of the charge density wave in monolayer NbSe2https://mtm.irb.hr/publication/benic-2025-machine/Sun, 17 Aug 2025 00:00:00 +0000https://mtm.irb.hr/publication/benic-2025-machine/Correlation effects in van der Waals CrXTe3 materials (X: Si, Ge) from X-ray spectroscopy studieshttps://mtm.irb.hr/publication/jin-2025-correlation/Fri, 15 Aug 2025 00:00:00 +0000https://mtm.irb.hr/publication/jin-2025-correlation/Photoinduced dynamics of CO on Ru (0001): Understanding experiments by simulations with all degrees of freedomhttps://mtm.irb.hr/publication/mladineo-2025-photoinduced/Mon, 28 Jul 2025 00:00:00 +0000https://mtm.irb.hr/publication/mladineo-2025-photoinduced/Exploring elastic properties of molecular crystals with universal machine learning interatomic potentialshttps://mtm.irb.hr/publication/kholtobina-2025-exploring/Sun, 01 Jun 2025 00:00:00 +0000https://mtm.irb.hr/publication/kholtobina-2025-exploring/Tuning Electronic Properties of Nanoporous Graphenehttps://mtm.irb.hr/publication/kretz-tuning-2025/Thu, 29 May 2025 00:00:00 +0000https://mtm.irb.hr/publication/kretz-tuning-2025/Computational investigation of uracil dimers in water and the role of classical potentialshttps://mtm.irb.hr/publication/ostojic-2025-computational/Fri, 23 May 2025 00:00:00 +0000https://mtm.irb.hr/publication/ostojic-2025-computational/Photoluminescence and Stability of 2D Ruddlesden--Popper Halide Perovskiteshttps://mtm.irb.hr/publication/ren-2025-photoluminescence/Mon, 19 May 2025 00:00:00 +0000https://mtm.irb.hr/publication/ren-2025-photoluminescence/Niobium Oxide for Microplastics Degradation—the Effect of Crystal Structure and Morphologyhttps://mtm.irb.hr/publication/rehman-2025-niobium/Thu, 15 May 2025 00:00:00 +0000https://mtm.irb.hr/publication/rehman-2025-niobium/Electron-mediated anharmonicity and its role in the Raman spectrum of graphenehttps://mtm.irb.hr/publication/erhardt-2025-electron/Tue, 29 Apr 2025 00:00:00 +0000https://mtm.irb.hr/publication/erhardt-2025-electron/Proximity effects in the graphene-Co3Sn2S2 interfacehttps://mtm.irb.hr/publication/zhang-2025-proximity/Fri, 25 Apr 2025 00:00:00 +0000https://mtm.irb.hr/publication/zhang-2025-proximity/Elucidation of the suppression of photoinduced segregation in 2D mixed halide, A2PbI2Br2: Critical role of A2PbBr4 photostabilityhttps://mtm.irb.hr/publication/ren-2025-elucidation/Fri, 18 Apr 2025 00:00:00 +0000https://mtm.irb.hr/publication/ren-2025-elucidation/Electronic properties of graphene interfaced with multiferroic van der Waals CuCrP2S6 from X-ray spectromicroscopy and DFThttps://mtm.irb.hr/publication/guo-2025-electronic/Wed, 05 Mar 2025 00:00:00 +0000https://mtm.irb.hr/publication/guo-2025-electronic/Increased resistance to photooxidation in Dion-Jacobson lead halide perovskites: Implication for perovskite device stabilityhttps://mtm.irb.hr/publication/ren-2025-increased/Wed, 05 Mar 2025 00:00:00 +0000https://mtm.irb.hr/publication/ren-2025-increased/Orbital analysis of electronic states for vdW material CoPS3 by scanning probe microscopyhttps://mtm.irb.hr/publication/fonin-2025-orbital/Wed, 05 Mar 2025 00:00:00 +0000https://mtm.irb.hr/publication/fonin-2025-orbital/Structural Evolution Leading to the Thermosalient Phase Transition of Oxitropium Bromidehttps://mtm.irb.hr/publication/klaser-2025-structural/Wed, 26 Feb 2025 00:00:00 +0000https://mtm.irb.hr/publication/klaser-2025-structural/Letter to the editor concerning “Direct spectroscopic evidence of magnetic proximity effect in MoS2 monolayer on graphene/Co”https://mtm.irb.hr/publication/voloshina-2025-letter/Tue, 25 Feb 2025 00:00:00 +0000https://mtm.irb.hr/publication/voloshina-2025-letter/Properties of an organic model S=1 Haldane chain systemhttps://mtm.irb.hr/publication/jakovac-2025-properties/Mon, 03 Feb 2025 00:00:00 +0000https://mtm.irb.hr/publication/jakovac-2025-properties/Bernal-stacked bilayer graphene on Rh(111): Clear evidence from ARPES and DFThttps://mtm.irb.hr/publication/voloshina-2025-bernal/Thu, 02 Jan 2025 00:00:00 +0000https://mtm.irb.hr/publication/voloshina-2025-bernal/The seventh blind test of crystal structure prediction: structure ranking methodshttps://mtm.irb.hr/publication/hunnisett-2024-seventh/Sun, 01 Dec 2024 00:00:00 +0000https://mtm.irb.hr/publication/hunnisett-2024-seventh/The reversible electron transfer within stimuli-responsive hydrochromic supramolecular material containing pyridinium oxime and hexacyanoferrate (II) ionshttps://mtm.irb.hr/publication/foretic-2024-reversible/Wed, 27 Nov 2024 00:00:00 +0000https://mtm.irb.hr/publication/foretic-2024-reversible/Multidimensional Neural Network Interatomic Potentials for CO on NaCl (100)https://mtm.irb.hr/publication/sinha-2024-multidimensional/Tue, 26 Nov 2024 00:00:00 +0000https://mtm.irb.hr/publication/sinha-2024-multidimensional/Thermosalient phase transitions from machine learning interatomic potentialhttps://mtm.irb.hr/publication/mladineo-2024-thermosalient/Mon, 07 Oct 2024 00:00:00 +0000https://mtm.irb.hr/publication/mladineo-2024-thermosalient/Neutral rhodol-based dyes expressing localization in mitochondriahttps://mtm.irb.hr/publication/ferraboschi-2024-neutral/Tue, 28 May 2024 00:00:00 +0000https://mtm.irb.hr/publication/ferraboschi-2024-neutral/Base-pairing of uracil and 2, 6-diaminopurine: from cocrystals to photoreactivityhttps://mtm.irb.hr/publication/stolar-2024-base/Wed, 08 May 2024 00:00:00 +0000https://mtm.irb.hr/publication/stolar-2024-base/Global machine learning potentials for molecular crystalshttps://mtm.irb.hr/publication/vzugec-2024-global/Tue, 16 Apr 2024 00:00:00 +0000https://mtm.irb.hr/publication/vzugec-2024-global/Direct in situ measurement of polymorphic transition temperatures under thermo-mechanochemical conditionshttps://mtm.irb.hr/publication/alic-2024-direct/Fri, 19 Jan 2024 00:00:00 +0000https://mtm.irb.hr/publication/alic-2024-direct/Light-Induced Intramolecular Electron Transfer in a 1D [CuFe] Coordination Polymer Containing the [Fe (C2O4) 3] 3--Corehttps://mtm.irb.hr/publication/molcanov-2023-light/Thu, 12 Oct 2023 00:00:00 +0000https://mtm.irb.hr/publication/molcanov-2023-light/Femtosecond laser-induced desorption of hydrogen molecules from Ru (0001): A systematic study based on machine-learned potentialshttps://mtm.irb.hr/publication/lindner-2023-femtosecond/Mon, 24 Jul 2023 00:00:00 +0000https://mtm.irb.hr/publication/lindner-2023-femtosecond/A Neural Network to Decipher Organic Electrochemical Transistors’ Multivariate Responses for Cation Recognitionhttps://mtm.irb.hr/publication/pecqueur-2023-neural/Thu, 18 May 2023 00:00:00 +0000https://mtm.irb.hr/publication/pecqueur-2023-neural/Crystal structure prediction of quasi-two-dimensional lead halide perovskiteshttps://mtm.irb.hr/publication/ovvcar-2023-crystal/Mon, 15 May 2023 00:00:00 +0000https://mtm.irb.hr/publication/ovvcar-2023-crystal/Structure-Related Evolution of Magnetic Order in Anisidinium Tetrachlorocuprates (II)https://mtm.irb.hr/publication/topic-2023-structure/Tue, 09 May 2023 00:00:00 +0000https://mtm.irb.hr/publication/topic-2023-structure/Electron correlations rule the phonon-driven instability in single-layer TiSe 2https://mtm.irb.hr/publication/novko-2022-electron/Wed, 07 Dec 2022 00:00:00 +0000https://mtm.irb.hr/publication/novko-2022-electron/Sustainable solid form screening: mechanochemical control over nucleobase hydrogen-bonded organic framework polymorphismhttps://mtm.irb.hr/publication/stolar-2022-sustainable/Sat, 13 Aug 2022 00:00:00 +0000https://mtm.irb.hr/publication/stolar-2022-sustainable/Mixed halide ordering as a tool for the stabilization of Ruddlesden--Popper Structureshttps://mtm.irb.hr/publication/ovcar-2022-mixed/Thu, 05 May 2022 00:00:00 +0000https://mtm.irb.hr/publication/ovcar-2022-mixed/Absence of isotope effects in the photo-induced desorption of CO from saturated Pd (111) at high laser fluencehttps://mtm.irb.hr/publication/muzas-2022-absence/Sun, 20 Mar 2022 00:00:00 +0000https://mtm.irb.hr/publication/muzas-2022-absence/O2 on Ag (110): A puzzle for exchange-correlation functionalshttps://mtm.irb.hr/publication/lonvcaric-2022-o-2/Tue, 01 Feb 2022 00:00:00 +0000https://mtm.irb.hr/publication/lonvcaric-2022-o-2/Synthesis of murunskite single crystals: A bridge between cuprates and pnictideshttps://mtm.irb.hr/publication/tolj-2021-synthesis/Wed, 01 Sep 2021 00:00:00 +0000https://mtm.irb.hr/publication/tolj-2021-synthesis/Enhanced light emission performance of mixed cation perovskite films—The effect of solution stoichiometry on crystallizationhttps://mtm.irb.hr/publication/liu-2021-enhanced/Fri, 20 Aug 2021 00:00:00 +0000https://mtm.irb.hr/publication/liu-2021-enhanced/Photoinduced desorption dynamics of CO from Pd (111): a neural network approachhttps://mtm.irb.hr/publication/serrano-2021-photoinduced/Mon, 19 Jul 2021 00:00:00 +0000https://mtm.irb.hr/publication/serrano-2021-photoinduced/Magnetoelectric Multiferroicity and Magnetic Anisotropy in Guanidinium Copper (II) Formate Crystalhttps://mtm.irb.hr/publication/vsenjug-2021-magnetoelectric/Fri, 12 Feb 2021 00:00:00 +0000https://mtm.irb.hr/publication/vsenjug-2021-magnetoelectric/Uncovering the Electron-Phonon Interplay and Dynamical Energy-Dissipation Mechanisms of Hot Carriers in Hybrid Lead Halide Perovskiteshttps://mtm.irb.hr/publication/chan-2021-uncovering/Wed, 27 Jan 2021 00:00:00 +0000https://mtm.irb.hr/publication/chan-2021-uncovering/Tunable Fulleretic Sodalite MOFs: Highly Efficient and Controllable Entrapment of C60 Fullerene via Mechanochemistryhttps://mtm.irb.hr/publication/martinez-2020-tunable/Fri, 11 Dec 2020 00:00:00 +0000https://mtm.irb.hr/publication/martinez-2020-tunable/Structural, Electrical, and Magnetic Versatility of the Oxalate-Based [CuFe] Compounds Containing 2, 2′: 6′, 2 ″-Terpyridine: Anion-Directed Synthesishttps://mtm.irb.hr/publication/kanizaj-2020-structural/Tue, 08 Dec 2020 00:00:00 +0000https://mtm.irb.hr/publication/kanizaj-2020-structural/Proximity-induced magnetization in graphene: Towards efficient spin gatinghttps://mtm.irb.hr/publication/bosnar-2020-proximity/Fri, 13 Nov 2020 00:00:00 +0000https://mtm.irb.hr/publication/bosnar-2020-proximity/Mechanochemical Metathesis between AgNO3 and NaX (X= Cl, Br, I) and Ag2XNO3 Double-Salt Formationhttps://mtm.irb.hr/publication/lukin-2020-mechanochemical/Mon, 03 Aug 2020 00:00:00 +0000https://mtm.irb.hr/publication/lukin-2020-mechanochemical/Phase control for quasi-2D blue emitters by spacer cation engineeringhttps://mtm.irb.hr/publication/tam-2020-phase/Thu, 07 May 2020 00:00:00 +0000https://mtm.irb.hr/publication/tam-2020-phase/Engineering Cu/TiO2@ N-Doped C Interfaces Derived from an Atom-Precise Heterometallic CuII4TiIV5 Cluster for Efficient Photocatalytic Hydrogen Evolutionhttps://mtm.irb.hr/publication/yuan-2020-engineering/Fri, 10 Apr 2020 00:00:00 +0000https://mtm.irb.hr/publication/yuan-2020-engineering/Se intercalation between PtSe 2 and Pt surface in synthesis of PtSe 2 by direct selenization of Pt surfacehttps://mtm.irb.hr/publication/bosnar-2020-se/Sat, 22 Feb 2020 00:00:00 +0000https://mtm.irb.hr/publication/bosnar-2020-se/Vibrational response and motion of carbon monoxide on Cu (100) driven by femtosecond laser pulses: Molecular dynamics with electronic frictionhttps://mtm.irb.hr/publication/scholz-2019-vibrational/Thu, 26 Dec 2019 00:00:00 +0000https://mtm.irb.hr/publication/scholz-2019-vibrational/Mixed Spacer Cation Stabilization of Blue-Emitting n= 2 Ruddlesden--Popper Organic--Inorganic Halide Perovskite Filmshttps://mtm.irb.hr/publication/leung-2020-mixed/Sun, 15 Dec 2019 00:00:00 +0000https://mtm.irb.hr/publication/leung-2020-mixed/Controlling the Polymorphism and Topology Transformation in Porphyrinic Zirconium Metal--Organic Frameworks via Mechanochemistryhttps://mtm.irb.hr/publication/karadeniz-2019-controlling/Wed, 20 Nov 2019 00:00:00 +0000https://mtm.irb.hr/publication/karadeniz-2019-controlling/Strong acoustic plasmons in chemically doped graphene induced by a nearby metal surfacehttps://mtm.irb.hr/publication/despoja-2019-strong/Mon, 04 Nov 2019 00:00:00 +0000https://mtm.irb.hr/publication/despoja-2019-strong/The non-ideal organic electrochemical transistors impedancehttps://mtm.irb.hr/publication/pecqueur-2019-non/Thu, 01 Aug 2019 00:00:00 +0000https://mtm.irb.hr/publication/pecqueur-2019-non/Direct Assembly and Metal-Ion Binding Properties of Oxytocin Monolayer on Gold Surfaceshttps://mtm.irb.hr/publication/mervinetsky-2019-direct/Tue, 30 Jul 2019 00:00:00 +0000https://mtm.irb.hr/publication/mervinetsky-2019-direct/Ladder-like [CrCu] coordination polymers containing unique bridging modes of [Cr (C 2 O 4) 3] 3- and Cr 2 O 7 2-https://mtm.irb.hr/publication/kanivzaj-2019-ladder/Mon, 29 Apr 2019 00:00:00 +0000https://mtm.irb.hr/publication/kanivzaj-2019-ladder/CO Stretch Vibration Lives Long on Au (111)https://mtm.irb.hr/publication/loncaric-2019-co/Tue, 19 Feb 2019 00:00:00 +0000https://mtm.irb.hr/publication/loncaric-2019-co/Mechanochemical carbon-carbon bond formation that proceeds via a cocrystal intermediatehttps://mtm.irb.hr/publication/lukin-2018-mechanochemical/Fri, 30 Nov 2018 00:00:00 +0000https://mtm.irb.hr/publication/lukin-2018-mechanochemical/Strong two-dimensional plasmon in Li-intercalated hexagonal boron-nitride film with low dampinghttps://mtm.irb.hr/publication/lonvcaric-2018-strong/Wed, 19 Sep 2018 00:00:00 +0000https://mtm.irb.hr/publication/lonvcaric-2018-strong/Experimental and Theoretical Study of Selectivity in Mechanochemical Cocrystallization of Nicotinamide with Anthranilic and Salicylic Acidhttps://mtm.irb.hr/publication/lukin-2018-experimental/Tue, 27 Feb 2018 00:00:00 +0000https://mtm.irb.hr/publication/lukin-2018-experimental/From a square core to square opening: structural diversity and magnetic properties of the oxo-bridged [Cr III Nb V] complexeshttps://mtm.irb.hr/publication/juric-2018-square/Tue, 06 Feb 2018 00:00:00 +0000https://mtm.irb.hr/publication/juric-2018-square/Imaging of optically active defects with nanometer resolutionhttps://mtm.irb.hr/publication/feng-2018-imaging/Fri, 02 Feb 2018 00:00:00 +0000https://mtm.irb.hr/publication/feng-2018-imaging/Strong anisotropic interaction controls unusual sticking and scattering of CO at Ru (0001)https://mtm.irb.hr/publication/lonvcaric-2017-strong/Mon, 06 Nov 2017 00:00:00 +0000https://mtm.irb.hr/publication/lonvcaric-2017-strong/Energy loss and surface temperature effects in ab initio molecular dynamics simulations: N adsorption on Ag (111) as a case studyhttps://mtm.irb.hr/publication/novko-2017-energy/Mon, 28 Aug 2017 00:00:00 +0000https://mtm.irb.hr/publication/novko-2017-energy/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 Phenomenonhttps://mtm.irb.hr/publication/loncaric-2017-reversible/Thu, 13 Jul 2017 00:00:00 +0000https://mtm.irb.hr/publication/loncaric-2017-reversible/Femtosecond-laser induced dynamics of CO on Ru (0001): Deep insights from a hot-electron friction model including surface motionhttps://mtm.irb.hr/publication/scholz-2016-femtosecond/Wed, 26 Oct 2016 00:00:00 +0000https://mtm.irb.hr/publication/scholz-2016-femtosecond/Molecular dynamics simulation of O 2 adsorption on Ag (110) from first principles electronic structure calculationshttps://mtm.irb.hr/publication/lonvcaric-2016-molecular/Mon, 12 Sep 2016 00:00:00 +0000https://mtm.irb.hr/publication/lonvcaric-2016-molecular/Femtosecond laser pulse induced desorption: A molecular dynamics simulationhttps://mtm.irb.hr/publication/loncaric-2016-femtosecond-desorption/Thu, 01 Sep 2016 00:00:00 +0000https://mtm.irb.hr/publication/loncaric-2016-femtosecond-desorption/Femtosecond-laser-driven molecular dynamics on surfaces: Photodesorption of molecular oxygen from Ag (110)https://mtm.irb.hr/publication/lonvcaric-2016-femtosecond/Tue, 05 Jan 2016 00:00:00 +0000https://mtm.irb.hr/publication/lonvcaric-2016-femtosecond/Dissociative dynamics of O 2 on Ag (110)https://mtm.irb.hr/publication/lonvcaric-2015-dissociative/Thu, 01 Jan 2015 00:00:00 +0000https://mtm.irb.hr/publication/lonvcaric-2015-dissociative/Benchmarking van der Waals functionals with noncontact RPA calculations on graphene-Ag (111)https://mtm.irb.hr/publication/lonvcaric-2014-benchmarking/Mon, 18 Aug 2014 00:00:00 +0000https://mtm.irb.hr/publication/lonvcaric-2014-benchmarking/Quasiparticle spectra and excitons of organic molecules deposited on substrates: G 0 W 0-BSE approach applied to benzene on graphene and metallic substrateshttps://mtm.irb.hr/publication/despoja-2013-quasiparticle/Tue, 31 Dec 2013 00:00:00 +0000https://mtm.irb.hr/publication/despoja-2013-quasiparticle/