Article-Journal

Energy loss and surface temperature effects in ab initio molecular dynamics simulations: N adsorption on Ag (111) as a case study

Dino Novko, Ivor Lončarić, María Blanco-Rey, J Iñaki Juaristi, Maite Alducin

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

Ivor Lončarić, Jasminka Popović, Vito Despoja, Sanja Burazer, Ivan Grgičević, Dean Popović, Željko Skoko

Femtosecond-laser induced dynamics of CO on Ru (0001): Deep insights from a hot-electron friction model including surface motion

Robert Scholz, Gereon Floß, Peter Saalfrank, Gernot Füchsel, Ivor Lončarić, JI Juaristi

Molecular dynamics simulation of O 2 adsorption on Ag (110) from first principles electronic structure calculations

Ivor Lončarić, M Alducin, JI Juaristi

Femtosecond laser pulse induced desorption: A molecular dynamics simulation

Ivor Lončarić, Maite Alducin, Peter Saalfrank, J. Iñaki Juaristi

Femtosecond-laser-driven molecular dynamics on surfaces: Photodesorption of molecular oxygen from Ag (110)

Ivor Lončarić, M Alducin, P Saalfrank, JI Juaristi

Dissociative dynamics of O 2 on Ag (110)

Ivor Lončarić, M Alducin, J I Juaristi

Benchmarking van der Waals functionals with noncontact RPA calculations on graphene-Ag (111)

Ivor Lončarić, Vito Despoja

Quasiparticle spectra and excitons of organic molecules deposited on substrates: G 0 W 0-BSE approach applied to benzene on graphene and metallic substrates

V Despoja, Ivor Lončarić, DJ Mowbray, L Marušić