Research output: Contribution to journal › Article › peer-review
Research output: Contribution to journal › Article › peer-review
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TY - JOUR
T1 - Magnetic Anisotropy of Single-Ion Magnet (PPh4)2 [ReF6]·2H2O
AU - Taran, L. S.
AU - Elfimova, V. Y.
AU - Streltsov, S. V.
N1 - We are grateful to Prof. A. Rogalev for drawing our attention to this Re SIM and E. Komleva for a detailed discussion of the paper. Computations were performed on the Uran supercomputer at the Mikheev Institute of Metal Physics, Ural Branch, Russian Academy of Sciences.
PY - 2023/4/1
Y1 - 2023/4/1
N2 - Studying of single-molecule magnets has sprung many surprises such as, e.g., quantum tunneling of the magnetization, which is strongly related to the presence of a magnetic anisotropy. Electron spin resonance and inelastic neutron scattering measurements of (PPh4)2[ReF6]⋅2H2O complex evidence an unprecedented large single-site magnetic anisotropy of D∼35 K in this material. Using state-of-the-art ab initio calculations we found that the single-ion anisotropy is indeed very large (but does not exceed 12 K) and revealed the physical mechanism lying behind this phenomenon.
AB - Studying of single-molecule magnets has sprung many surprises such as, e.g., quantum tunneling of the magnetization, which is strongly related to the presence of a magnetic anisotropy. Electron spin resonance and inelastic neutron scattering measurements of (PPh4)2[ReF6]⋅2H2O complex evidence an unprecedented large single-site magnetic anisotropy of D∼35 K in this material. Using state-of-the-art ab initio calculations we found that the single-ion anisotropy is indeed very large (but does not exceed 12 K) and revealed the physical mechanism lying behind this phenomenon.
UR - https://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcAuth=tsmetrics&SrcApp=tsm_test&DestApp=WOS_CPL&DestLinkType=FullRecord&KeyUT=000966673800005
UR - http://www.scopus.com/inward/record.url?partnerID=8YFLogxK&scp=85152675002
U2 - 10.1134/S0021364023600623
DO - 10.1134/S0021364023600623
M3 - Article
VL - 117
SP - 606
EP - 611
JO - JETP Letters
JF - JETP Letters
SN - 0021-3640
IS - 8
ER -
ID: 40051155