Structure, solvent, and relativistic effects on the NMR chemical shifts in square-planar transition-metal complexes: assessment of DFT approaches.
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On the calculation of second-order magnetic properties using subsystem approaches in a relativistic framework.Calculations of atomic magnetic nuclear shielding constants based on the two-component normalized elimination of the small component method.Giant spin-orbit effects on (1)H and (13)C NMR shifts for uranium(vi) complexes revisited: role of the exchange-correlation response kernel, bonding analyses, and new predictions.On the significant relativistic heavy atom effect on 13C NMR chemical shifts of β- and γ-carbons in seleno- and telluroketonesOn the HALA effect in the NMR carbon shielding constants of the compounds containing heavy p-elements
P2860
Structure, solvent, and relativistic effects on the NMR chemical shifts in square-planar transition-metal complexes: assessment of DFT approaches.
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2015 nî lūn-bûn
@nan
2015年の論文
@ja
2015年論文
@yue
2015年論文
@zh-hant
2015年論文
@zh-hk
2015年論文
@zh-mo
2015年論文
@zh-tw
2015年论文
@wuu
2015年论文
@zh
2015年论文
@zh-cn
name
Structure, solvent, and relati ...... assessment of DFT approaches.
@en
type
label
Structure, solvent, and relati ...... assessment of DFT approaches.
@en
prefLabel
Structure, solvent, and relati ...... assessment of DFT approaches.
@en
P2860
P50
P356
P1476
Structure, solvent, and relati ...... : assessment of DFT approaches
@en
P2093
Jan Novotný
P2860
P304
24944-24955
P356
10.1039/C5CP04214C
P407
P577
2015-10-01T00:00:00Z