引用本文:
Hui Xiao, Liwen Ding, Jingyan Liu, Zhihui Jia, Liming Cao, Ziyi Du, Chunting He. Solid-State Molecular Dynamics of a Torsion-Variable Ammonium Confined in Deformable Supramolecular Framework[J]. Chinese Journal of Structural Chemistry,
2023, 42(2): 100003.
doi:
10.1016/j.cjsc.2023.100003
Citation: Hui Xiao, Liwen Ding, Jingyan Liu, Zhihui Jia, Liming Cao, Ziyi Du, Chunting He. Solid-State Molecular Dynamics of a Torsion-Variable Ammonium Confined in Deformable Supramolecular Framework[J]. Chinese Journal of Structural Chemistry, 2023, 42(2): 100003. doi: 10.1016/j.cjsc.2023.100003
Citation: Hui Xiao, Liwen Ding, Jingyan Liu, Zhihui Jia, Liming Cao, Ziyi Du, Chunting He. Solid-State Molecular Dynamics of a Torsion-Variable Ammonium Confined in Deformable Supramolecular Framework[J]. Chinese Journal of Structural Chemistry, 2023, 42(2): 100003. doi: 10.1016/j.cjsc.2023.100003
Solid-State Molecular Dynamics of a Torsion-Variable Ammonium Confined in Deformable Supramolecular Framework
摘要:
The switchable molecular dynamics and order-disorder transformation of (i-PrNHMe2)+ cation embedded in a deformable {[Ni(NCS)6]4-} supramolecular framework accompanied by solid-state structural phase transitions are reported, finding the confined swinging or flipping of the cation as a whole is assisted by a synergistic change of its torsion angle.
English
Solid-State Molecular Dynamics of a Torsion-Variable Ammonium Confined in Deformable Supramolecular Framework
Abstract:
The switchable molecular dynamics and order-disorder transformation of (i-PrNHMe2)+ cation embedded in a deformable {[Ni(NCS)6]4-} supramolecular framework accompanied by solid-state structural phase transitions are reported, finding the confined swinging or flipping of the cation as a whole is assisted by a synergistic change of its torsion angle.
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Key words:
- Solid-state molecular dynamics
- / Supramolecular framework
- / Phase transition
- / Dielectric
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