Unusual magnetic properties of mixed-valence system: Multiconfigurational method theoretical study on Mn2+ cation

2005 ◽  
Vol 123 (13) ◽  
pp. 134306 ◽  
Author(s):  
Bingwu Wang ◽  
Zhida Chen
Keyword(s):  
Magnetic Properties ◽  
Theoretical Study ◽  
Mixed Valence

scholarly journals The electronic structures and magnetic properties of mixed-valence Fe-based metal–organic VNU-15 frameworks: a theoretical study from linear response DFT+U calculations

RSC Advances ◽  
2020 ◽  
Vol 10 (57) ◽  
pp. 34690-34701
Author(s):  
Diem Thi-Xuan Dang ◽  
Hieu Cao Dong ◽  
Yoshiyuki Kawazoe ◽  
Jer-Lai Kuo ◽  
Duc Nguyen-Manh
Keyword(s):  
Magnetic Properties ◽  
Electronic Structures ◽  
Linear Response ◽  
Theoretical Study ◽  
Metal Organic Framework ◽  
Mixed Valence ◽  
Metal Organic ◽  
Photocatalytic Applications ◽  
Organic Framework

The effects of DMA+ cation orientation on the electronic structures and magnetic properties of the metal–organic framework VNU-15 are investigated, and VNU-15 is proved to be a prospective material for photocatalytic applications.

Comment on “Pressure-induced structural and valence transition in AgO” by C. Hou, J. Botana, X. Zhang, X. Wang and M. Miao, Phys. Chem. Chem. Phys., 2016, 18, 15322

2016 ◽  
Vol 18 (46) ◽  
pp. 31973-31974 ◽  
Author(s):  
Mariana Derzsi ◽  
Wojciech Grochala
Keyword(s):  
Electronic Structure ◽  
Recent Article ◽  
Theoretical Study ◽  
Mixed Valence ◽  
Chem Phys ◽  
External Pressure ◽  
Valence Transition ◽  
Mixed Valence Compound ◽  
Phys Chem Chem Phys

The recent article by Hou et al. has focused on a theoretical study of mixed valence compound AgO in order to elucidate the nature of the electronic structure of this system as a function of external pressure.

Structures, stabilities, and magnetic properties of Cu-doped ZnnOn (n=3,9,12) clusters: A theoretical study

2012 ◽  
Vol 989 ◽  
pp. 90-96 ◽  
Author(s):  
Yongliang Yong ◽  
Zhen Wang ◽  
Kai Liu ◽  
Bin Song ◽  
Pimo He
Keyword(s):  
Magnetic Properties ◽  
Theoretical Study

Synthesis, structure, and magnetic properties of dicopper and tricobalt complexes based on N-(2-pyridylmethyl)iminodiethanol

2015 ◽  
Vol 2 (8) ◽  
pp. 763-770 ◽  
Author(s):  
Jong Won Shin ◽  
Ah Rim Jeong ◽  
Shinya Hayami ◽  
Dohyun Moon ◽  
Kil Sik Min
Keyword(s):  
Magnetic Properties ◽  
Copper Complex ◽  
Mixed Valence ◽  
Molecular Magnetism ◽  
Dinuclear Copper

A novel unsymmetrical dinuclear copper complex [Cu(H2pmide)(NO3)Cu(Hpmide)](NO3)2 (1) and a mixed-valence trinuclear cobalt compound [(pmide)2Co3(CH3CO2)2(NCS)2]·4CH3OH (2) have been prepared and characterized using structure and molecular magnetism.

Sign in / Sign up

Export Citation Format

Share Document