Juan Carlos Roldao

Affiliations: 
2018-2022 IMDEA Nanociencia 
 2022-2023 IKERBASQUE. Donostia International Physics Center (DIPC). Euskal Herriko Unibertsitatea (UPV/EHU). 
 2023- University of Valencia, Spain, Valencia, Comunidad Valenciana, Spain 
Area:
Quantum Chemistry
Google:
"Juan Roldao"
Mean distance: (not calculated yet)
 
BETA: Related publications

Publications

You can help our author matching system! If you notice any publications incorrectly attributed to this author, please sign in and mark matches as correct or incorrect.

Preethalayam P, Roldao JC, Castet F, et al. (2024) 3,4-Dimethylenecyclobutene: A Building Block for Design of Macrocycles with Excited State Aromatic Low-Lying High-Spin States. Chemistry (Weinheim An Der Bergstrasse, Germany). e202303549
Kwon Y, Lee J, Noh Y, et al. (2023) Formation and degradation of strongly reducing cyanoarene-based radical anions towards efficient radical anion-mediated photoredox catalysis. Nature Communications. 14: 92
Roldao JC, Oliveira EF, Milián-Medina B, et al. (2022) Accurate Calculation of Excited-State Absorption for Small-to-Medium-Sized Conjugated Oligomers: Multiconfigurational Treatment vs Quadratic Response TD-DFT. Journal of Chemical Theory and Computation
Roldao JC, Oliveira EF, Milián-Medina B, et al. (2022) Quantum-chemistry study of the ground and excited state absorption of distyrylbenzene: Multi vs single reference methods. The Journal of Chemical Physics. 156: 044102
Wu Z, Roldao JC, Rauch F, et al. (2022) Pure Boric Acid Does Not Show Room Temperature Phosphorescence (RTP). Angewandte Chemie (International Ed. in English)
Liu Q, Wackenhut F, Wang L, et al. (2021) Direct Observation of Structural Heterogeneity and Tautomerization of Single Hypericin Molecules. The Journal of Physical Chemistry Letters. 1025-1031
Gierschner J, Dos Santos GC, Roldao JC, et al. (2020) Combined Spectroscopic and TD-DFT Analysis to Elucidate Substituent and Acidochromic Effects in Organic Dyes A Case Study on Amino- vs. Nitro-Substituted 2,4-Diphenylquinolines. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
Eskandari M, Roldao JC, Cerezo J, et al. (2020) Counterion-Mediated Crossing of the Cyanine Limit in Crystals and Fluid Solution: Bond Length Alternation and Spectral Broadening Unveiled by Quantum Chemistry. Journal of the American Chemical Society. 142: 2835-2843
See more...