Tunable magnetism in metal adsorbed fluorinated nanoporous graphene

Kumar, Pankaj; Sharma, Vinit; Reboredo, Fernando A.; Yang, Li-Ming; Pushpa, Raghani

doi:10.1038/srep31841

Title: Tunable magnetism in metal adsorbed fluorinated nanoporous graphene

Journal Article · Wed Aug 24 00:00:00 EDT 2016 · Scientific Reports

DOI:https://doi.org/10.1038/srep31841· OSTI ID:1324102

Kumar, Pankaj ^[1]; Sharma, Vinit ^[2]; Reboredo, Fernando A. ^[2]; Yang, Li-Ming ^[3]; Pushpa, Raghani ^[1]

Boise State Univ., ID (United States)
Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States)
Huazhong University of Science and Technology, Wuhan (China)

Developing nanostructures with tunable magnetic states is crucial for designing novel data storage and quantum information devices. Using density functional theory, we study the thermodynamic stability and magnetic properties of tungsten adsorbed tri-vacancy fluorinated (TVF) graphene. We demonstrate a strong structure-property relationship and its response to external stimuli via defect engineering in graphene-based materials. Complex interplay between defect states and the chemisorbed atom results in a large magnetic moment of 7 μ_B along with high in-plane magneto-crystalline anisotropy energy (MAE) of 17 meV. Under the influence of electric field, spin crossover effect accompanied by a change in the MAE is observed. The ascribed change in spin-configuration is caused by the modification of exchange coupling between defect states and a change in the occupation of d-orbitals of the metal complex. In conclusion, our predictions open a promising way towards controlling the magnetic properties in graphene based spintronic and non-volatile memory devices.

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Research Organization:: Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES)

Grant/Contract Number:: AC05-00OR22725

OSTI ID:: 1324102

Journal Information:: Scientific Reports, Vol. 6, Issue 6; ISSN 2045-2322

Publisher:: Nature Publishing GroupCopyright Statement

Country of Publication:: United States

Language:: English

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Cited by: 12 works

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