kitchinhub,github

python modules designed to find classification boundaries

Documentation and scripts that are useful on gilgamesh

PhD dissertation for John Kitchin

Kitchin Group Repository - group meeting schedule, notes, etc...

Simulating Temperature Programmed Desorption of Oxygen on {P}t(111) Using {DFT} Derived Coverage Dependent Desorption Barriers

Electrocatalytic Oxygen Evolution With an Immobilized TAML Activator

A Linear Response, DFT+U Study of Trends in the Oxygen Evolution Activity of Transition Metal Rutile Dioxides

Core level shifts in Cu-Pd alloys as a function of bulk composition and structure

Alkaline Electrolyte and Fe Impurity Effects on the Performance and Active-Phase Structure of {NiOOH} Thin Films for {OER} Catalysis Applications

Data sharing in Surface Science

Examples of effective data sharing in scientific publishing

Investigating the Energetic Ordering of Stable and Metastable TiO2 Polymorphs Using DFT+U and Hybrid Functionals

The Role of Vdw Interactions in Coverage Dependent Adsorption Energies of Atomic Adsorbates on Pt(111) and Pd(111)

Comparative microfluidic screening of amino acid salt solutions for post-combustion CO2 capture

Neural Network and ReaxFF comparison for Au properties http://dx.doi.org/10.1002/qua.25115

Automating data sharing through authoring tools

Modification of the Surface Electronic and Chemical Properties of Pt(111) By Subsurface 3d Transition Metals

First-principles study of the Cu-Pd phase diagram

Role of Strain and Ligand Effects in the Modification of the Electronic and Chemical Properties of Bimetallic Surfaces

kitchinhub Goto Github PK