Structural and Magnetic Properties of CoGen−(n=2-11) Clusters: Photoelectron Spectroscopy and Density Functional Calculations

ChemPhysChem ◽  
2014 ◽  
Vol 15 (18) ◽  
pp. 3987-3993 ◽  
Author(s):  
Xiao-Jiao Deng ◽  
Xiang-Yu Kong ◽  
Xi-Ling Xu ◽  
Hong-Guang Xu ◽  
Wei-Jun Zheng
Keyword(s):  
Magnetic Properties ◽  
Photoelectron Spectroscopy ◽  
Density Functional Calculations ◽  
Density Functional ◽  
Structural And Magnetic Properties

Non-collinear antiferromagnetism to compensated ferrimagnetism in Ti(Fe1-xCox)2 (x = 0, 0.5 and 1) alloys: Experiment and theory

2021 ◽  
Author(s):  
S. Shanmukharao Samatham ◽  
Akhilesh Kumar Patel ◽  
Alexey Lukoyanov ◽  
K. G. Suresh ◽  
R Nirmala
Keyword(s):  
Magnetic Properties ◽  
Density Functional Calculations ◽  
Density Functional ◽  
X Ray Diffraction ◽  
X Ray ◽  
Structural And Magnetic Properties

The manifestation of structural and magnetic properties of Co substituted TiFe2 is investigated using powder x-ray diffraction, magnetization and density functional calculations. The alloys TiFe2 and TiFeCo crystallize in the...

Photoelectron spectroscopy and density functional calculations of AgSin− (n = 3–12) clusters

2013 ◽  
Vol 138 (24) ◽  
pp. 244312 ◽  
Author(s):  
Xiang-Yu Kong ◽  
Xiao-Jiao Deng ◽  
Hong-Guang Xu ◽  
Zheng Yang ◽  
Xi-Ling Xu ◽  
...  
Keyword(s):  
Photoelectron Spectroscopy ◽  
Density Functional Calculations ◽  
Density Functional

Photoelectron spectroscopy and density functional calculations of CnSm− (n = 2–7; m = 1, 2) clusters

2015 ◽  
Vol 17 (46) ◽  
pp. 31011-31022 ◽  
Author(s):  
Xi-Ling Xu ◽  
Xiao-Jiao Deng ◽  
Hong-Guang Xu ◽  
Wei-Jun Zheng
Keyword(s):  
Photoelectron Spectroscopy ◽  
Density Functional Calculations ◽  
Density Functional

The vertical detachment energies of both CnS− and CnS2− (n = 2–7) clusters exhibit a strong odd–even alternation with an increasing number of carbon atoms.

Structural and bonding properties of Cu3O3− and Cu3O4− clusters: anion photoelectron spectroscopy and density functional calculations

2018 ◽  
Vol 20 (31) ◽  
pp. 20622-20628 ◽  
Author(s):  
Xi-Ling Xu ◽  
Bin Yang ◽  
Zhi-You Wei ◽  
Guo-Jin Cao ◽  
Hong-Guang Xu ◽  
...  
Keyword(s):  
Photoelectron Spectroscopy ◽  
Density Functional Calculations ◽  
Density Functional ◽  
Bonding Properties ◽  
Anion Photoelectron Spectroscopy

The structures of Cu3O3− and Cu3O4− were determined by combination of anion photoelectron spectroscopy and density functional calculations. The Cu–Cu interactions in Cu3O3− and Cu3O4− are weak.

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