Toward CH4 dissociation and C diffusion during Ni/Fe-catalyzed carbon nanofiber growth: A density functional theory study

DFT studies of dry reforming of methane on Ni catalyst

(2009) Yi-An Zhu et al.   CATALYSIS TODAY

A synergetic description of carbon nanofiber growth

(2009) I. A. Merkulov et al.   JOURNAL OF APPLIED PHYSICS

Comparative study of the kinetics of methane steam reforming on supported Ni and Sn/Ni alloy catalysts: The impact of the formation of Ni alloy on chemistry

(2009) Eranda Nikolla et al.   JOURNAL OF CATALYSIS

First-principles study of methane dehydrogenation on a bimetallic Cu/Ni(111) surface

(2009) Wei An et al.   JOURNAL OF CHEMICAL PHYSICS

First Principles Study of the Effect of Carbon and Boron on the Activity of a Ni Catalyst

(2009) Jing Xu et al.   Journal of Physical Chemistry C

Computational Investigation of Thermochemistry and Kinetics of Steam Methane Reforming on Ni(111) under Realistic Conditions

(2009) D. Wayne Blaylock et al.   Journal of Physical Chemistry C

A grid-based Bader analysis algorithm without lattice bias

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

Magnetically recyclable Fe–Ni alloy catalyzed dehydrogenation of ammonia borane in aqueous solution under ambient atmosphere

(2009) Jun-Min Yan et al.   JOURNAL OF POWER SOURCES

Nucleation of Ni–Fe alloy near the spinodal

(2008) Y.J. Lü et al.   ACTA MATERIALIA

Optimization and scale-up of CNF production based on intrinsic kinetic data obtained from TEOM

(2008) I KVANDE et al.   JOURNAL OF CATALYSIS

Effect of boron on the stability of Ni catalysts during steam methane reforming

(2008) J XU et al.   JOURNAL OF CATALYSIS

Optimization methods for finding minimum energy paths

(2008) Daniel Sheppard et al.   JOURNAL OF CHEMICAL PHYSICS

Chemisorption and Reactivity of CHx (x = 0−4) on Fe−Co Alloy Surfaces

(2008) John M. H. Lo et al.   Journal of Physical Chemistry C

First Principles Study of the Stability and the Formation Kinetics of Subsurface and Bulk Carbon on a Ni Catalyst

(2008) Jing Xu et al.   Journal of Physical Chemistry C