The significance of the alkene size and the nature of the metal ion in metal–alkene complexes: a theoretical study

2012 ◽  
Vol 41 (16) ◽  
pp. 4965 ◽  
Author(s):  
J. Richard Premkumar ◽  
Dolly Vijay ◽  
G. Narahari Sastry
Keyword(s):  
Metal Ion ◽  
Theoretical Study

scholarly journals Влияние орбитального упорядочения на спектры магнитного резонанса в зарядово-упорядоченных и фрустрированных манганитах

2019 ◽  
Vol 61 (5) ◽  
pp. 841
Author(s):  
Л.Э. Гончарь
Keyword(s):  
Metal Ion ◽  
Alkaline Earth ◽  
Theoretical Study ◽  
Earth Metal ◽  
Exchange Interactions ◽  
Alkaline Earth Metal ◽  
Antiferromagnetic Resonance ◽  
Rare Earth Ion ◽  
Magnetic Structures ◽  
Low Dimensional

A theoretical study of the interrelation of the crystal structure, charge, orbital, and magnetic subsystems in R1–xAxMnO3 charge-ordered manganites has been carried out (where R3+ is the rare earth ion, A2+ is the alkaline earth metal ion, x = 0.5, 2/3). The model of orbital-dependent exchange interactions and single-ion anisotropy is used. The presence of quasi-low-dimensional magnetic structures is exhibited. The spin waves spectra and antiferromagnetic resonance spectra are calculated.

ChemInform Abstract: Experimental and Theoretical Study of the First Thiacalixcrowns (I) and Their Alkali Metal Ion Complexes.

ChemInform ◽  
2010 ◽  
Vol 33 (8) ◽  
pp. no-no
Author(s):  
Veronique Lamare ◽  
Jean-Francois Dozol ◽  
Pierre Thuery ◽  
Martine Nierlich ◽  
Zouhair Asfari ◽  
...  
Keyword(s):  
Alkali Metal ◽  
Metal Ion ◽  
Theoretical Study ◽  
Metal Ion Complexes ◽  
Alkali Metal Ion

Metal ion binding by pyridylethyl-containing polymers: experimental and theoretical study

2016 ◽  
Vol 45 (31) ◽  
pp. 12372-12383 ◽  
Author(s):  
Svetlana Bratskaya ◽  
Alexey Voit ◽  
Yuliya Privar ◽  
Albert Ziatdinov ◽  
Alexander Ustinov ◽  
...  
Keyword(s):  
Metal Ion ◽  
Theoretical Study ◽  
Ion Binding ◽  
Metal Ion Binding ◽  
Polymer Precursors

Structure of polymer precursors significantly affects binding efficiency of their pyridylethylated derivatives toward Cu2+, Ni2+, and Ag+ ions.

Density functional theoretical study on attachment sites of Mg2+ and Ca2+ and metal ion affinity to Crenulatin molecule

2008 ◽  
Vol 19 (3) ◽  
pp. 541-548 ◽  
Author(s):  
Xinlu Cheng ◽  
Xinfang Su ◽  
Xingwen Zhao ◽  
Hengjie Chen
Keyword(s):  
Metal Ion ◽  
Density Functional ◽  
Theoretical Study ◽  
Attachment Sites

Theoretical study of metal ion impact on geometric and electronic properties of terbutaline compounds

2019 ◽  
Vol 150 (7) ◽  
pp. 1355-1364
Author(s):  
Zhong Ai Guo ◽  
Jing Yan Xian ◽  
Li Rong Rong ◽  
Hong Qin ◽  
Zhong Jie
Keyword(s):  
Electronic Properties ◽  
Metal Ion ◽  
Theoretical Study ◽  
Ion Impact ◽  
Geometric And Electronic Properties
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