Electronic Structure and Redox Properties of Metal Nitride Endohedral Fullerenes M3N@C2n(M=Sc, Y, La, and Gd; 2n=80, 84, 88, 92, 96)

Trimetallic Nitride Endohedral Fullerenes: Experimental and Theoretical Evidence for the M3N6+@C2n6−model

(2009) Manuel N. Chaur et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Metal-Cage Bonding, Molecular Structures and Vibrational Spectra of Endohedral Fullerenes: Bridging Experiment and Theory

(2009) A. A. Popov   Journal of Computational and Theoretical Nanoscience

A grid-based Bader analysis algorithm without lattice bias

(2009) W Tang et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Carbon Pyramidalization in Fullerene Cages Induced by the Endohedral Cluster: Non-Scandium Mixed Metal Nitride Clusterfullerenes

(2008) Shangfeng Yang et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Sc3N@C80-Ferrocene Electron-Donor/Acceptor Conjugates as Promising Materials for Photovoltaic Applications

(2008) Julio R. Pinzón et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

New egg-shaped fullerenes: non-isolated pentagon structures of Tm3N@Cs(51 365)-C84 and Gd3N@Cs(51 365)-C84

(2008) Tianming Zuo et al.   CHEMICAL COMMUNICATIONS

The Isomers of Gadolinium Scandium Nitride Clusterfullerenes GdxSc3−xN@C80 (x=1, 2) and Their Influence on Cluster Structure

(2008) Shangfeng Yang et al.   CHEMISTRY-A EUROPEAN JOURNAL

New M3N@C2n Endohedral Metallofullerene Families (M=Nd, Pr, Ce;n=40–53): Expanding the Preferential Templating of the C88 Cage and Approaching the C96 Cage

(2008) Manuel N. Chaur et al.   CHEMISTRY-A EUROPEAN JOURNAL

Metal Nitride Cluster Fullerene M3N@C80(M=Y, Sc) Based Dyads: Synthesis, and Electrochemical, Theoretical and Photophysical Studies

(2008) Julio R. Pinzón et al.   CHEMISTRY-A EUROPEAN JOURNAL

Lanthanum Nitride Endohedral Fullerenes La3N@C2n(43≤n≤55): Preferential Formation of La3N@C96

(2008) Manuel N. Chaur et al.   CHEMISTRY-A EUROPEAN JOURNAL

Preparation and Structural Characterization of theIhand theD5hIsomers of the Endohedral Fullerenes Tm3N@C80: Icosahedral C80Cage Encapsulation of a Trimetallic Nitride Magnetic Cluster with Three Uncoupled Tm3+Ions

(2008) Tianming Zuo et al.   INORGANIC CHEMISTRY

Charged States of Sc3N@C68: An In Situ Spectroelectrochemical Study of the Radical Cation and Radical Anion of a Non-IPR Fullerene

(2008) Peter Rapta et al.   JOURNAL OF PHYSICAL CHEMISTRY A

New Relativistic Atomic Natural Orbital Basis Sets for Lanthanide Atoms with Applications to the Ce Diatom and LuF3

(2008) Björn O. Roos et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Metal Atoms Collinear with the Spiro Carbon of 6,6-Open Adducts, M2@C80(Ad) (M = La and Ce, Ad = Adamantylidene)

(2008) Michio Yamada et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Selective Formation of a Symmetric Sc3N@C78Bisadduct:  Adduct Docking Controlled by an Internal Trimetallic Nitride Cluster

(2008) Ting Cai et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Hindered Cluster Rotation and45Sc Hyperfine Splitting Constant in Distonoid Anion Radical Sc3N@C80−, and Spatial Spin−Charge Separation as a General Principle for Anions of Endohedral Fullerenes with Metal-Localized Lowest Unoccupied Molecular Orbitals

(2008) Alexey A. Popov et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

M2@C79N (M = Y, Tb): Isolation and Characterization of Stable Endohedral Metallofullerenes Exhibiting M−M Bonding Interactions inside Aza[80]fullerene Cages

(2008) Tianming Zuo et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

A Distorted Tetrahedral Metal Oxide Cluster inside an Icosahedral Carbon Cage. Synthesis, Isolation, and Structural Characterization of Sc4(μ3-O)2@Ih-C80

(2008) Steven Stevenson et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Addition of Adamantylidene to La2@C78:  Isolation and Single-Crystal X-ray Structural Determination of the Monoadducts

(2007) Baopeng Cao et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY