2016
DOI: 10.1071/ch15174
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Prospects of Spin Catalysis on Spin-Polarized Graphene Heterostructures

Abstract: Extreme points on potential energy surfaces of Ni adatom on free-standing graphene and top:fcc and hcp:fcc graphene/ Ni(111) heterostructures in different spin states were studied using periodic boundary conditions density functional theory approach. It was found that the spin states of the substrates strongly influence the energy of the Ni adatom extreme points on potential energy surface by decreasing (top:fcc heterostructure) or increasing (hcp:fcc heterostructure) the total energies of Z 1 , Z 1 0 , and Z … Show more

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Cited by 3 publications
(3 citation statements)
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“…It is extremely interesting to study the physicochemical properties of endohedral metallofullerenes (EMFs), including their behavior under pressure. A significant influence of guest metal ions on EMF polymerization can be expected due to electron transfer to the fullerene cage and spin appearance . However, so far, the lack of methods for their large-scale synthesis has not allowed such experimental studies.…”
Section: Introductionmentioning
confidence: 99%
See 1 more Smart Citation
“…It is extremely interesting to study the physicochemical properties of endohedral metallofullerenes (EMFs), including their behavior under pressure. A significant influence of guest metal ions on EMF polymerization can be expected due to electron transfer to the fullerene cage and spin appearance . However, so far, the lack of methods for their large-scale synthesis has not allowed such experimental studies.…”
Section: Introductionmentioning
confidence: 99%
“…A significant influence of guest metal ions on EMF polymerization can be expected due to electron transfer to the fullerene cage 7 and spin appearance. 8 However, so far, the lack of methods for their large-scale synthesis has not allowed such experimental studies.…”
Section: ■ Introductionmentioning
confidence: 99%
“…Taking into account the absence of spin-polarization, graphene can play a significant role as a part of novel heterostructures being the material that do not change the magnetic properties of other components allowing advanced transport properties. 2 Interfaces based on graphene/hBN have mobilities and carrier inhomogeneities that are almost an order of magnitude higher than devices based on SiO 2. 3,4 Due to simplicity of fabrication and opportunity to synthesize high-squared sheets, graphene is going to be the most popular material related to electronics in near future.…”
Section: Introductionmentioning
confidence: 99%