Theoretical screening of efficient single-atom catalysts for nitrogen fixation based on a defective BN monolayer.

Z, Ma; Z, Cui; C, Xiao; W, Dai; Y, Lv; Q, Li; R, Sa

doi:10.1039/c9nr08969a

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Theoretical screening of efficient single-atom catalysts for nitrogen fixation based on a defective BN monolayer.

Shared by NobleBlocks on Jan 1, 2020 • 12:00 AM UTC

Authors:

Ma Z

Cui Z

Xiao C

Abstract

The electrocatalytic reduction of naturally abundant N2 to NH3 is an attractive approach to replace the Haber-Bosch nitrogen-fixation process that causes enormous energy consumption and greenhouse gas emissions. However, designing high-performance catalysts toward the electrocatalytic N2 reduction r...

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