国家/地区 Belgium（9）
关键词
出版物 CHEMICAL PHYSICS LE.（2） JOURNAL OF MOLECULA.（2） JOURNAL OF PHYSICAL.（2）
出版时间 2013（4） 2012（2）
机构 VRIJE UNIV B.（6） HASSELT UNIV（3）
作者 HAJGATO B（9）

Solvation of graphene sheets vs. dimerization: A theoretical study

INDIAN JOURNAL OF CHEMISTRY SECTION AINORGANIC BIOINORGANIC PHYSICAL THEORETICAL ANALYTICAL CHEMISTRY

HAJGATO B, GURYEL S, DAUPHIN Y, BLAIRON JM, VAN LIER G, MILTNER HE, DE PROFT F, GEERLINGS P

Inducing Aromaticity Patterns and Tuning the Electronic Transport of Zigzag Graphene Nanoribbons via Edge Design

JOURNAL OF PHYSICAL CHEMISTRY C

MARTINMARTINEZ FJ, FIAS S, HAJGATO B, VAN LIER G, DE PROFT F, GEERLINGS P

Half-metallicity of graphene nanoribbons and related systems: a new quantum mechanical El Dorado for nanotechnologies aEuro broken vertical bar or a hype for materials scientists?

JOURNAL OF MOLECULAR MODELING

DELEUZE MS, HUZAK M, HAJGATO B

Out-of-plane shear and out-of plane Young's modulus of double-layer graphene

CHEMICAL PHYSICS LETTERS

HAJGATO B, GURYEL S, DAUPHIN Y, BLAIRON JM, MILTNER HE, VAN LIER G, DE PROFT F, GEERLINGS P

Effect of structural defects and chemical functionalisation on the intrinsic mechanical properties of graphene

PHYSICAL CHEMISTRY CHEMICAL PHYSICS

GURYEL S, HAJGATO B, DAUPHIN Y, BLAIRON JM, MILTNER HE, DE PROFT F, GEERLINGS P, VAN LIER G

Quenching of magnetism in hexagonal graphene nanoflakes by non-local electron correlation

CHEMICAL PHYSICS LETTERS

HAJGATO B, DELEUZE MS

Theoretical Investigation of the Intrinsic Mechanical Properties of Single- and Double-Layer Graphene

JOURNAL OF PHYSICAL CHEMISTRY C

HAJGATO B, GURYEL S, DAUPHIN Y, BLAIRON JM, MILTNER HE, VAN LIER G, DE PROFT F, GEERLINGS P

Half-metallicity and spin-contamination of the electronic ground state of graphene nanoribbons and related systems: An impossible compromise?

JOURNAL OF CHEMICAL PHYSICS

HUZAK M, DELEUZE MS, HAJGATO B

A computational study on the role of noncovalent interactions in the stability of polymer/graphene nanocomposites

JOURNAL OF MOLECULAR MODELING

GURYEL S, ALONSO M, HAJGATO B, DAUPHIN Y, VAN LIER G, GEERLINGS P, DE PROFT F