Excited-state dynamics of luminescent transition metal complexes with metallophilic and donor–acceptor interactions
Luminescent transition metal complexes have attracted much attention owing to their
utilization in a variety of photochemical applications such as light-emitting devices …
utilization in a variety of photochemical applications such as light-emitting devices …
Exploiting the quantum mechanically derived force field for functional materials simulations
A Odinokov, A Yakubovich, WJ Son, Y Jung… - npj Computational …, 2021 - nature.com
The computational design of functional materials relies heavily on large-scale atomistic
simulations. Such simulations are often problematic for conventional classical force fields …
simulations. Such simulations are often problematic for conventional classical force fields …
Exploiting the quantum mechanically derived force field for functional materials simulations
O Alexey, A Yakubovich, S Won-Joon… - NPJ Computational …, 2021 - search.proquest.com
The computational design of functional materials relies heavily on large-scale atomistic
simulations. Such simulations are often problematic for conventional classical force fields …
simulations. Such simulations are often problematic for conventional classical force fields …
[HTML][HTML] Supramolecular approach in energy conversion devices
RC Amaral, KPS Zanoni, LS Matos… - Journal of the Brazilian …, 2020 - SciELO Brasil
This review summarizes investigations carried out at the Laboratory of Photochemistry and
Energy Conversion (LFCE) in the University of São Paulo dealing with design and …
Energy Conversion (LFCE) in the University of São Paulo dealing with design and …
Passively Sampled Environmental Films Show Geographic Variability and Host a Variety of Microorganisms
JS Grant, PM Richards, CR Anderton… - ACS Earth and Space …, 2019 - ACS Publications
Environmental films are ubiquitous coatings that form on virtually all surfaces exposed to the
troposphere. This work analyzes large-molecular-weight species in native environmental …
troposphere. This work analyzes large-molecular-weight species in native environmental …
Study of the Synthesis and Properties of Ir (III) Complexes Based on Phosphine Carbonylimide Derivative as Auxiliary Ligand
QM Guo, GL Huang, XY Yin, JJ Bian… - Bulletin of the …, 2020 - Wiley Online Library
Three iridium complexes of (dfppy) 2Ir (DAPB),(dfppy) 2Ir (DAPB), and (dfppy) 2Ir (DAPB)
were synthesized by using phosphine carbonylimide derivative as auxiliary ligand and …
were synthesized by using phosphine carbonylimide derivative as auxiliary ligand and …
2-Chloro-4,6-bis{(E)-3-methoxy-4-[(4-methoxybenzyl)oxy]styryl}pyrimidine: Synthesis, Spectroscopic and Computational Evaluation
OA Chaves, V Sueth-Santiago, DCA Pinto… - Molbank, 2021 - mdpi.com
A novel curcumin analog namely 2-chloro-4, 6-bis {(E)-3-methoxy-4-[(4-methoxybenzyl) oxy]-
styryl} pyrimidine (compound 7) was synthesized by three-step reaction. The condensation …
styryl} pyrimidine (compound 7) was synthesized by three-step reaction. The condensation …
[PDF][PDF] Propriedades fotofísicas de complexos heterolépticos de Ir (III) e heterobimetálico Ir (III)–Eu (III) emissores no deep-red para aplicação em concentradores …
RC Silva - 2022 - repositorio.unesp.br
A Energia solar é uma das fontes de energia renováveis que mais se destaca devido à sua
disponibilidade em função do intenso fluxo de irradiância solar sobre a Terra. Sua …
disponibilidade em função do intenso fluxo de irradiância solar sobre a Terra. Sua …