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Unveiling the Mechanisms Ruling the Efficient Hydrogen Evolution Reaction with Mitrofanovite Pt3Te4

TLDR
In this paper, the physicochemical mechanisms ruling the electrocatalytic activity of recently discovered mitrofanovite (Pt3Te4) mineral were revealed by means of electrocatalysis tests, surface-science techniques and density functional theory.
Abstract
By means of electrocatalytic tests, surface-science techniques and density functional theory, we unveil the physicochemical mechanisms ruling the electrocatalytic activity of recently discovered mitrofanovite (Pt3Te4) mineral. Mitrofanovite represents a very promising electrocatalyst candidate for energy-related applications, with a reduction of costs by 47% compared to pure Pt and superior robustness to CO poisoning. We show that Pt3Te4 is a weak topological metal with the Z 2 invariant, exhibiting electrical conductivity (∼4 × 106 S/m) comparable with pure Pt. In hydrogen evolution reaction (HER), the electrode based on bulk Pt3Te4 shows a very small overpotential of 46 mV at 10 mA cm-2 and a Tafel slope of 36-49 mV dec-1 associated with the Volmer-Heyrovsky mechanism. The outstanding ambient stability of Pt3Te4 also provides durability of the electrode and long-term stability of its efficient catalytic performances.

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Nitrogen Doped Carbon Encapsulated Hierarchical NiMoN as Highly Active and Durable HER Electrode for Repeated ON/OFF Water Electrolysis

TL;DR: In this paper , a hydrogen evolution reaction (HER) electrode with hierarchical NiMoN microrod arrays encapsulated by nitrogen doped ultra-thin carbon layer and in-situ grown on nickel foam (labeled NF) was reported.
Journal ArticleDOI

Efficient Hydrogen Evolution Reaction with Bulk and Nanostructured Mitrofanovite Pt3Te4

TL;DR: In this paper , the key features of electrocatalysis with mitrofanovite (Pt3Te4), a recently discovered mineral with superb performances in hydrogen evolution reaction, were discussed.
Journal ArticleDOI

Experimental and Theoretical Insights into Enhanced Hydrogen Evolution over PtCo Nanoalloys Anchored on a Nitrogen-Doped Carbon Matrix.

TL;DR: In this article , a uniform PtCo nanoparticles are grown on N-doped carbon frameworks via pyrolyzing Pt and Co ions adsorbed polyaniline, whereby the nanostructure of the nanoalloys can be effectively tuned by controlling the calcination temperature.
Journal ArticleDOI

Atomic order transition of TiNiPt nanoparticles supported on carbon nanotubes for stable hydrogen evolution reaction

TL;DR: In this paper , atomically ordered and disordered Ti50NixPt50-x/CNT catalysts are presented for hydrogen evolution reaction (HER) due to their unique surface and electronic structures.
References
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Journal ArticleDOI

Generalized Gradient Approximation Made Simple

TL;DR: A simple derivation of a simple GGA is presented, in which all parameters (other than those in LSD) are fundamental constants, and only general features of the detailed construction underlying the Perdew-Wang 1991 (PW91) GGA are invoked.
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Special points for brillouin-zone integrations

TL;DR: In this article, a method for generating sets of special points in the Brillouin zone which provides an efficient means of integrating periodic functions of the wave vector is given, where the integration can be over the entire zone or over specified portions thereof.
Journal ArticleDOI

QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials

TL;DR: QUANTUM ESPRESSO as discussed by the authors is an integrated suite of computer codes for electronic-structure calculations and materials modeling, based on density functional theory, plane waves, and pseudopotentials (norm-conserving, ultrasoft, and projector-augmented wave).
Journal ArticleDOI

Exfoliation of layered double hydroxides for enhanced oxygen evolution catalysis

TL;DR: This work demonstrates the promising catalytic activity of single-layered double hydroxides for the oxygen evolution reaction and reports an orthogonal approach to improve the activity of catalysts without alternating their compositions or structures.
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