Time-resolved vacuum-ultraviolet photoelectron spectroscopy of the ùAu state of acetylene.

Authors: Razmus, Weronika O., Prlj, Antonio, Seifert, Nathan A., Bonanomi, Matteo, Callegari, Carlo, Danailov, Miltcho, Decleva, Piero, Demidovich, Alexander, De Ninno, Giovanni, Devetta, Michele, Faccialà, Davide, Feifel, Raimund, Giannessi, Luca, Piteša, Tomislav, Powis, Ivan, Raimondi, Lorenzo, Reid, Katharine L., Ribič, Primož Rebernik, Spezzani, Carlo, Squibb, Richard J.

Source: Journal of Chemical Physics; 2/7/2025, Vol. 162 Issue 5, p1-15, 15p

Subject Terms: PHOTOELECTRON spectra, MASS spectrometry, PHOTOELECTRON spectroscopy, ELECTRONIC structure, ACETYLENE

Efficient Excitonic Configuration Interaction for Large-Scale Multichromophoric Systems Using the Resolution-of-Identity Approximation.

Authors: Piteša, Tomislav, Mai, Sebastian, González, Leticia

Source: Journal of Physical Chemistry Letters; 3/20/2025, Vol. 16 Issue 11, p2800-2807, 8p

Excitonic Configuration Interaction: Going Beyond the Frenkel Exciton Model.

Authors: Piteša, Tomislav, Polonius, Severin, González, Leticia, Mai, Sebastian

Source: Journal of Chemical Theory & Computation; 07/09/2024, Vol. 20 Issue 13, p5609-5634, 26p

Photochemical Ring-Opening Reaction of 1,3-Cyclohexadiene: Identifying the True Reactive State

Authors: Travnikova, Oksana, Piteša, Tomislav, Ponzi, Aurora, Sapunar, Marin, Squibb, Richard James, Richter, Robert, Finetti, Paola, Di Fraia, Michele, De Fanis, Alberto, Mahne, Nicola, Manfredda, Michele, Zhaunerchyk, Vitali, Marchenko, Tatiana, Guillemin, Renaud, Journel, Loic, Prince, Kevin Charles, Callegari, Carlo, Simon, Marc, Feifel, Raimund, Decleva, Piero, Došlić, Nad̵a, Piancastelli, Maria Novella

Source: Journal of the American Chemical Society; December 2022, Vol. 144 Issue: 48 p21878-21886, 9p

Anticooperativity of Multiple Halogen Bonds and Its Effect on Stoichiometry of Cocrystals of Perfluorinated Iodobenzenes.

Authors: Bedeković, Nikola, Piteša, Tomislav, Eraković, Mihael, Stilinović, Vladimir, Cinčić, Dominik

Source: Crystal Growth & Design; 4/6/2022, Vol. 22 Issue 4, p2644-2653, 10p

An unusual intermolecular interaction between a lone pair and an electron-rich π-electron system of a quinoid dianion

Authors: Vuković, Vedran, Piteša, Tomislav, Jelsch, Christian, Wenger, Emmanuel, Molčanov, Krešimir

Source: Crystal Growth & Design; October 2021, Vol. 21 Issue: 10 p5651-5658, 8p

Combined Surface-Hopping, Dyson Orbital, and B-Spline Approach for the Computation of Time-Resolved Photoelectron Spectroscopy Signals: The Internal Conversion in Pyrazine

Authors: Piteša, Tomislav, Sapunar, Marin, Ponzi, Aurora, Gelin, Maxim F., Došlić, Nađa, Domcke, Wolfgang, Decleva, Piero

Source: Journal of Chemical Theory and Computation; August 2021, Vol. 17 Issue: 8 p5098-5109, 12p

The Morpholinyl Oxygen Atom as an Acceptor Site for Halogen-Bonded Cocrystallization of Organic and Metal–Organic Units

Authors: Nemec, Vinko, Piteša, Tomislav, Friščić, Tomislav, Cinčić, Dominik

Source: Crystal Growth & Design; June 2020, Vol. 20 Issue: 6 p3617-3624, 8p

Highly Efficient Algorithms for CIS Type Excited State Wave Function Overlaps.

Authors: Sapunar, Marin, Piteša, Tomislav, Davidović, Davor, Došlić, Nadja

Source: Journal of Chemical Theory & Computation; Jun2019, Vol. 15 Issue 6, p3461-3469, 9p

This result is not displayed to guests.
Login for full access.

Bifurcated and Monocentric Halogen Bonds in Cocrystals of Metal(II) Acetylacetonates with p‑Dihalotetrafluorobenzenes.

Authors: Stilinović, Vladimir, Grgurić, Toni, Piteša, Tomislav, Nemec, Vinko, Cinčić, Dominik

Source: Crystal Growth & Design; Feb2019, Vol. 19 Issue 2, p1245-1256, 12p

Photoelimination of Nitrogen from Diazoalkanes: Involvement of Higher Excited Singlet States in the Carbene Formation

Authors: Piteša, Tomislav, Alešković, Marija, Becker, Kristin, Basarić, Nikola, Došlić, Nađa

Source: Journal of the American Chemical Society; May 2020, Vol. 142 Issue: 21 p9718-9724, 7p