Structures, electronic and magnetic properties of transition metal inserted W6O18 clusters

Zhao, Zhen; Li, Zhi

doi:10.1007/s11224-022-02106-8

Struct Chem

2022

DOI: 10.1007/s11224-022-02106-8

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Structures, electronic and magnetic properties of transition metal inserted W6O18 clusters

Zhen Zhao

Zhi Li

Abstract: Structures, electronic and magnetic properties of transition metal (TM) inserted W 6 O 18 clusters have been investigated by using rst principles. The results reveal that the Ti

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Structures, electronic and magnetic properties of transition metal inserted W6O18 clusters

Abstract: Structures, electronic and magnetic properties of transition metal (TM) inserted W 6 O 18 clusters have been investigated by using rst principles. The results reveal that the Ti

Cited by 4 publications

References 46 publications

First-principles calculations on the structures and electronic properties of the TMW2On (TM = Mn–Ni, n = 1–6) clusters

First-principles calculations on the structures and electronic properties of the TMW2On (TM = Mn–Ni, n = 1–6) clusters

Structures, electronic properties and dipole magnitudes of the TMWn–1O3n (TM = Mn, Fe and Co, n = 2 ~ 6) clusters

Density functional theory calculations on the ammonia interaction with BmNm (m = 47, 71, and 95) tubular clusters

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