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Unravelling the electronic structure, bonding, and magnetic properties of inorganic dysprosocene analogues [Dy(E₄)₂]^- (E = N, P, As, CH).

Tarannum I, Singh SK. Tarannum I, et al. Phys Chem Chem Phys. 2024 Oct 7. doi: 10.1039/d4cp03016h. Online ahead of print. Phys Chem Chem Phys. 2024. PMID: 39373561

A highly anisotropic family of hexagonal bipyramidal Dy(III) unsaturated 18-crown-6 complexes exceeding the blockade barrier over 2700 K: a computational exploration.

Moorthy S, Tarannum I, Kumari K, Singh SK. Moorthy S, et al. Among authors: tarannum i. Dalton Trans. 2024 Jul 23;53(29):12073-12079. doi: 10.1039/d4dt00632a. Dalton Trans. 2024. PMID: 38787652

Effect of diamagnetic Zn(II) ions on the SMM properties of a series of trinuclear ZnDy₂ and tetranuclear Zn₂Dy₂ (Ln^III = Dy, Tb, Gd) complexes: combined experimental and theoretical studies.

Shukla P, Tarannum I, Roy S, Rajput A, Lama P, Singh SK, Kłak J, Lee J, Das S. Shukla P, et al. Among authors: tarannum i. Dalton Trans. 2024 Apr 23;53(16):7053-7066. doi: 10.1039/d4dt00417e. Dalton Trans. 2024. PMID: 38564260

A Spin-Frustrated Azide- and Alkoxide-Bridged Heterobimetallic Mixed-Valence Mn^IIMn^III₂Ni^II₄ Disc with S = 17/2 or 19/2.

Kumar J, Tarannum I, Singh SK, Mondal KC. Kumar J, et al. Among authors: tarannum i. ACS Omega. 2024 Jan 23;9(5):5809-5818. doi: 10.1021/acsomega.3c08817. eCollection 2024 Feb 6. ACS Omega. 2024. PMID: 38343953 Free PMC article.

Understanding electrostatics and covalency effects in highly anisotropic organometallic sandwich dysprosium complexes [Dy(C_mR_m)₂] (where R = H, SiH₃, CH₃ and m = 4 to 9): a computational perspective.

Tarannum I, Moorthy S, Singh SK. Tarannum I, et al. Dalton Trans. 2023 Oct 31;52(42):15576-15589. doi: 10.1039/d3dt01646c. Dalton Trans. 2023. PMID: 37786345

Interplay between anisotropy and magnetic exchange to modulate the magnetic relaxation behaviours of phenoxo bridged Dy₂ dimers with axial β-diketonate co-ligands.

Roy S, Shukla P, Ahmed N, Du MH, Tarannum I, Kong XJ, Gupta T, Singh SK, Das S. Roy S, et al. Among authors: tarannum i. Dalton Trans. 2022 Dec 6;51(47):18187-18202. doi: 10.1039/d2dt03117e. Dalton Trans. 2022. PMID: 36398616

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