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6 Results Found

  • Article
  • Open Access
2,183 Views
29 Pages

2 December 2022

Description of interacting spin systems relies on understanding the spectral properties of the corresponding spin Hamiltonians. However, the eigenvalue problems arising here lead to algebraic problems too complex to be analytically tractable. This is...

  • Article
  • Open Access
1,344 Views
18 Pages

10 December 2024

Understanding the flow, loss, and recovery of the information between a system and its environment is essential for advancing quantum technologies. The central spin system serves as a useful model for a single qubit, offering valuable insights into h...

  • Article
  • Open Access
1 Citations
4,502 Views
28 Pages

The prediction of paramagnetic NMR (pNMR) chemical shifts in molecules containing heavy atoms presents a significant challenge to computational quantum chemistry. The importance of meeting this challenge lies in the central role that NMR plays in the...

  • Article
  • Open Access
5 Citations
3,925 Views
29 Pages

New Syntheses, Analytic Spin Hamiltonians, Structural and Computational Characterization for a Series of Tri-, Hexa- and Hepta-Nuclear Copper (II) Complexes with Prototypic Patterns

  • Ana Maria Toader,
  • Maria Cristina Buta,
  • Fanica Cimpoesu,
  • Andrei-Iulian Toma,
  • Christina Marie Zalaru,
  • Ludmila Otilia Cinteza and
  • Marilena Ferbinteanu

15 March 2021

We present a series of pyrazolato-bridged copper complexes with interesting structures that can be considered prototypic patterns for tri-, hexa- and hepta- nuclear systems. The trinuclear shows an almost regular triangle with a μ3-OH central group....

  • Article
  • Open Access
10 Citations
4,386 Views
23 Pages

Asymmetric Dinuclear Lanthanide(III) Complexes from the Use of a Ligand Derived from 2-Acetylpyridine and Picolinoylhydrazide: Synthetic, Structural and Magnetic Studies

  • Diamantoula Maniaki,
  • Panagiota S. Perlepe,
  • Evangelos Pilichos,
  • Sotirios Christodoulou,
  • Mathieu Rouzières,
  • Pierre Dechambenoit,
  • Rodolphe Clérac and
  • Spyros P. Perlepes

10 July 2020

A family of four Ln(III) complexes has been synthesized with the general formula [Ln2(NO3)4(L)2(S)] (Ln = Gd, Tb, Er, and S = H2O; 1, 2 and 4, respectively/Ln = Dy, S = MeOH, complex 3), where HL is the flexible ditopic ligand N’-(1-(pyridin-2-...