Transition Metal Hydrazide-Based Hydrogen-Storage Materials: the First Atoms-In-Molecules Analysis of the Kubas Interaction

Group 3 and Lanthanide Boryl Compounds: Syntheses, Structures, and Bonding Analyses of Sc−B, Y−B, and Lu−B σ-Coordinated NHC Analogues

(2011) Liban M. A. Saleh et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Small Molecule Activation by Uranium Tris(aryloxides): Experimental and Computational Studies of Binding of N2, Coupling of CO, and Deoxygenation Insertion of CO2under Ambient Conditions

(2011) Stephen M. Mansell et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Bond catastrophes in rhodium complexes: experimental charge-density studies of [Rh(C7H8)(PtBu3)Cl] and [Rh(C7H8)(PCy3)Cl]

(2010) Hazel A. Sparkes et al.   ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE

Covalency in CeIV and UIV Halide and N-Heterocyclic Carbene Bonds

(2010) Polly L. Arnold et al.   CHEMISTRY-A EUROPEAN JOURNAL

Covalency in AnCp4 (An = Th–Cm): a comparison of molecular orbital, natural population and atoms-in-molecules analyses

(2010) Matthew J. Tassell et al.   DALTON TRANSACTIONS

Does covalency really increase across the 5f series? A comparison of molecular orbital, natural population, spin and electron density analyses of AnCp3(An = Th–Cm; Cp = η5-C5H5)

(2010) Ian Kirker et al.   DALTON TRANSACTIONS

Functionalized Porous Silicas with Unsaturated Early Transition Metal Moieties as Hydrogen Storage Materials: Comparison of Metal and Oxidation State

(2010) Ahmad Hamaed et al.   Journal of Physical Chemistry C

Computational Study of Silica-Supported Transition Metal Fragments for Kubas-type Hydrogen Storage

(2010) Claire V. J. Skipper et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Design and Synthesis of Vanadium Hydrazide Gels for Kubas-Type Hydrogen Adsorption: A New Class of Hydrogen Storage Materials

(2010) Tuan K. A. Hoang et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Accuracy of density functional theory methods for weakly bonded systems: The case of dihydrogen binding on metal centers

(2010) Y. Y. Sun et al.   PHYSICAL REVIEW B

Exploiting the Kubas Interaction in the Design of Hydrogen Storage Materials

(2009) Tuan K. A. Hoang et al.   ADVANCED MATERIALS

Ti-Substituted Boranes as Hydrogen Storage Materials: A Computational Quest for the Ideal Combination of Stable Electronic Structure and Optimal Hydrogen Uptake

(2009) Cheng-Gen Zhang et al.   CHEMISTRY-A EUROPEAN JOURNAL

Hydrogen activation on organometallic complexes and H2 production, utilization, and storage for future energy

(2009) Gregory J. Kubas   JOURNAL OF ORGANOMETALLIC CHEMISTRY

Enhancement of Hydrogen Adsorption in Metal−Organic Frameworks by the Incorporation of the Sulfonate Group and Li Cations. A Multiscale Computational Study

(2009) Andreas Mavrandonakis et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Crossover between multipole Coulomb and Kubas interactions in hydrogen adsorption on metal-graphene complexes

(2009) Gyubong Kim et al.   PHYSICAL REVIEW B

Hydrogen Storage in Microporous Metal-Organic Frameworks with Exposed Metal Sites

(2008) Mircea Dincă et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Materials for hydrogenstorage: current research trends and perspectives

(2008) Annemieke W. C. van den Berg et al.   CHEMICAL COMMUNICATIONS

Titanium-functional group complexes for high-capacity hydrogen storage materials

(2008) Hoonkyung Lee et al.   SOLID STATE COMMUNICATIONS