Zobrazeno 1 - 4
of 4
pro vyhledávání: '"Christina Eleftheria Tzeliou"'
Publikováno v:
Inorganics, Vol 12, Iss 4, p 106 (2024)
Ferrocene has a unique structure, i.e., a central iron atom neatly sandwiched between two cyclopentadienyl rings, which has revolutionized the chemists’ views about how metals bind to organic π-systems. This structural arrangement leads to some fa
Externí odkaz:
https://doaj.org/article/2920f2af3b054971853fdf69761d6e50
Autor:
Constantinos Demetriou, Christina Eleftheria Tzeliou, Alexandros Androutsopoulos, Demeter Tzeli
Publikováno v:
Molecules, Vol 28, Iss 24, p 8016 (2023)
Boron presents an important role in chemistry, biology, and materials science. Diatomic transition-metal borides (MBs) are the building blocks of many complexes and materials, and they present unique electronic structures with interesting and peculia
Externí odkaz:
https://doaj.org/article/3c53515663dc4f4faf772ea1f072887f
Publikováno v:
Molecules, Vol 28, Iss 8, p 3565 (2023)
In the present paper, the photophysical properties of metallocene-4-amino-1,8-naphthalimide-piperazine molecules (1-M2+), as well as their oxidized and protonated derivatives (1−M3+, 1-M2+-H+, and 1-M3+-H+), where M = Fe, Co, and Ni, were studied v
Externí odkaz:
https://doaj.org/article/176f84691b1446848f27e51096f6277a
Publikováno v:
Molecules, Vol 27, Iss 9, p 2660 (2022)
The multiscaling quantum mechanics/molecular mechanics (QM/MM) approach was introduced in 1976, while the extensive acceptance of this methodology started in the 1990s. The combination of QM/MM approach with molecular dynamics (MD) simulation, otherw
Externí odkaz:
https://doaj.org/article/e3e0c11513004926869faed043fb6414