Lithium-decorated oxidized graphyne for hydrogen storage by first principles study

Prediction of hydrogen storage on Y-decorated graphene: A density functional theory study

(2014) Wenbo Liu et al.   APPLIED SURFACE SCIENCE

Hydrogen storage in porous graphene with Al decoration

(2014) Zhimin Ao et al.   INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

Vibrational and thermodynamic properties ofα-,β-,γ-, and 6, 6, 12-graphyne structures

(2014) Nihan Kosku Perkgöz et al.   NANOTECHNOLOGY

Syntheses and Properties of Graphyne Fragments: Trigonally Expanded Dehydrobenzo[12]annulenes

(2013) Kazukuni Tahara et al.   CHEMISTRY-A EUROPEAN JOURNAL

A comparative study of the reversible hydrogen storage behavior in several metal decorated graphyne

(2013) Yanhua Guo et al.   INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

Oxygen adsorption on single layer graphyne: a DFT study

(2013) Baotao Kang et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Ultra-high hydrogen storage capacity of Li-decorated graphyne: A first-principles prediction

(2012) Hongyu Zhang et al.   JOURNAL OF APPLIED PHYSICS

Lithium-decorated oxidized porous graphene for hydrogen storage by first principles study

(2012) Shi-han Huang et al.   JOURNAL OF APPLIED PHYSICS

Thermodynamically Stable Calcium-Decorated Graphyne as a Hydrogen Storage Medium

(2012) Ho Jun Hwang et al.   Journal of Physical Chemistry C

Remarkable Hydrogen Storage Capacity In Li-Decorated Graphyne: Theoretical Predication

(2012) Yanhua Guo et al.   Journal of Physical Chemistry C

Graphyne: Hexagonal network of carbon with versatile Dirac cones

(2012) Bog G. Kim et al.   PHYSICAL REVIEW B

Metal-dispersed porous graphene for hydrogen storage

(2011) Pakpoom Reunchan et al.   APPLIED PHYSICS LETTERS

High-capacity hydrogen storage medium: Ti doped fullerene

(2011) Jun Guo et al.   APPLIED PHYSICS LETTERS

Mechanical properties of graphyne

(2011) Steven W. Cranford et al.   CARBON

Hydrogen adsorption on Ce/BNNT systems: A DFT study

(2011) Zhi-Wei Zhang et al.   INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

Effect of the damping function in dispersion corrected density functional theory

(2011) Stefan Grimme et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Elastic, Electronic, and Optical Properties of Two-Dimensional Graphyne Sheet

(2011) Jun Kang et al.   Journal of Physical Chemistry C

Hydrogen Storage in Decorated Multiwalled Carbon Nanotubes by Ca, Co, Fe, Ni, and Pd Nanoparticles under Ambient Conditions

(2011) A. Reyhani et al.   Journal of Physical Chemistry C

High Capacity Hydrogen Storage in Ca Decorated Graphyne: A First-Principles Study

(2011) Chong Li et al.   Journal of Physical Chemistry C

Van der Waals density functionals applied to solids

(2011) Jiří Klimeš et al.   PHYSICAL REVIEW B

Ti-decorated C60 as catalyst for hydrogen generation and storage

(2010) Liping Huang et al.   APPLIED PHYSICS LETTERS

Boron-tuned bonding mechanism of Li-graphene complex for reversible hydrogen storage

(2010) Chun-Sheng Liu et al.   APPLIED PHYSICS LETTERS

Titanium-decorated graphene for high-capacity hydrogen storage studied by density functional simulations

(2010) Yali Liu et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Calcium-Decorated Graphene-Based Nanostructures for Hydrogen Storage

(2010) Hoonkyung Lee et al.   NANO LETTERS

High-capacity hydrogen storage in Al-adsorbed graphene

(2010) Z. M. Ao et al.   PHYSICAL REVIEW B

Graphene Oxide as an Ideal Substrate for Hydrogen Storage

(2009) Lu Wang et al.   ACS Nano

First-principles study of Pd-decorated carbon nanotube for hydrogen storage

(2009) H. Xiao et al.   CHEMICAL PHYSICS LETTERS

Theoretical Study of Hydrogen Storage in Ca-Coated Fullerenes

(2009) Qian Wang et al.   Journal of Chemical Theory and Computation

Ca-Decorated Graphene-Based Three-Dimensional Structures for High-Capacity Hydrogen Storage

(2009) Gyubong Kim et al.   Journal of Physical Chemistry C

Enhanced Hydrogen Storage on Li-Dispersed Carbon Nanotubes

(2009) W. Liu et al.   Journal of Physical Chemistry C

Calcium-decorated carbon nanotubes for high-capacity hydrogen storage: First-principles calculations

(2009) Hoonkyung Lee et al.   PHYSICAL REVIEW B

High-capacity hydrogen storage by metallized graphene

(2008) C. Ataca et al.   APPLIED PHYSICS LETTERS

Potential importance of hydrogen as a future solution to environmental and transportation problems

(2008) Mustafa Balat   INTERNATIONAL JOURNAL OF HYDROGEN ENERGY

First-principles study of interaction of molecular hydrogen with Li-doped carbon nanotube peapod structures

(2008) Li Chen et al.   PHYSICAL REVIEW B

Synthesis and properties of annulenic subunits of graphyne and graphdiyne nanoarchitectures

(2008) Michael M. Haley   PURE AND APPLIED CHEMISTRY