Adsorption of small hydrocarbon radicals on single walled carbon nanotubes of finite length von Wu, Jianhua, Hagelberg, Frank

Volltext

Do Stone–Wales Defects Alter the Magnetic and Transport Properties of Single-Walled Carbon Nanotubes? von Wu, Jianhua, Hagelberg, Frank, Dinadayalane, Tandabany C, Leszczynska, Danuta, Leszczynski, Jerzy

Volltext

Interaction between Atomic Lanthanide Impurities and Ultrashort Carbon Nanotubes of the Zigzag Type von Wu, Jianhua, Hagelberg, Frank

Volltext

Spin Transport Properties of zCrXY (X, Y = S,Se) Nanoribbons: Implications for Spintronics von Yeatts, Robert B., Hagelberg, Frank

Volltext

Comparative Investigation on Non-IPR C68 and IPR C78 Fullerenes Encaging Sc3N Molecules von Park, Sung Soo, Liu, Dan, Hagelberg, Frank

Volltext

Strained zigzag graphene nanoribbon devices with vacancies as perfect spin filters von Magno, Macon, Hagelberg, Frank

Volltext

A density functional theory investigation of CrSin (n=1–6) clusters von Han, Ju-Guang, Hagelberg, Frank

Volltext

Charge transfer and electron backdonation in metallofullerenes encapsulating NSc3 von Liu, Dan, Hagelberg, Frank, Park, Sung Soo

Volltext

Impact of internal electron transfer on the structure of C74 encapsulating Sc and La metal atom impurities von Liu, Dan, Hagelberg, Frank

Volltext

Structures, Stabilities, and Electronic Properties of Endo- and Exohedral Complexes of T10−Polyhedral Oligomeric Silsesquioxane Cages von Hossain, Delwar, Pittman, Charles U, Saebo, Svein, Hagelberg, Frank

Volltext

Magnetism in finite-sized single-walled carbon nanotubes of the zigzag type von Wu, Jianhua, Hagelberg, Frank

Volltext

Highly Stable [C60AuC60]+/– Dumbbells von Goulart, Marcelo, Kuhn, Martin, Martini, Paul, Chen, Lei, Hagelberg, Frank, Kaiser, Alexander, Scheier, Paul, Ellis, Andrew M

Volltext

Self-assembly of methanethiol on the reconstructed Au(111) surface von Nenchev, Georgi, Diaconescu, Bogdan, Hagelberg, Frank, Pohl, Karsten

Volltext

Refractive indices of liquid-forming organic compounds by density functional theory von Park, Sung Soo, Lee, Sanghun, Bae, Jae Young, Hagelberg, Frank

Volltext

Endohedral complexes of Polyhedral Oligomeric Silsesquioxane (POSS) cages with transition metal dihydrides von Wang, Xiqiao, Corn, John, Hagelberg, Frank

Volltext

Do methanethiol adsorbates on the Au(111) surface dissociate? von Zhou, Jian-Ge, Hagelberg, Frank

Volltext

Impact of Tube Curvature on the Ground-State Magnetism of Axially Confined Single-Walled Carbon Nanotubes of the Zigzag-Type von Wu, Jianhua, Hagelberg, Frank

Volltext

Computational Study on C80 Enclosing Mixed Trimetallic Nitride Clusters of the Form GdxM3-xN (M = Sc, Sm, Lu) von WU, Jianhua, HAGELBERG, Frank

Volltext

Density functional theory calculation of refractive indices of liquid-forming silicon oil compounds von Lee, Sanghun, Park, Sung Soo, Hagelberg, Frank

Volltext

Aggregates of PCBM molecules: A computational study von Kaiser, Alexander, Probst, Michael, Stretz, Holly A., Hagelberg, Frank

Volltext