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40 积分 2022-12-05 加入
Theoretical Insights on Au‐based Bimetallic Alloy Electrocatalysts for Nitrogen Reduction Reaction with High Selectivity and Activity
2天前
已完结
Screening of Silver‐Based Single‐Atom Alloy Catalysts for NO Electroreduction to NH3 by DFT Calculations and Machine Learning
1个月前
已完结
Recent implementations in LASP 3.0: Global neural network potential with multiple elements and better long-range description
3个月前
已完结
LASP: Fast global potential energy surface exploration
3个月前
已完结
Ternary intermetallic LaCoSi as a catalyst for N2 activation
8个月前
已完结
Rational design of selective metal catalysts for alcohol amination with ammonia
10个月前
已完结
A climbing image nudged elastic band method for finding saddle points and minimum energy paths
10个月前
已完结
Alloy Catalysts for Electrocatalytic CO2 Reduction
1年前
已完结
Unravelling the Reaction Mechanisms of N2 Fixation on Molybdenum Nitride: A Full DFT Study from the Pristine Surface to Heteroatom Anchoring
1年前
已完结
Interaction of nitrogen with iron surfaces I. Fe(100) and Fe(111)
1年前
已完结
Enhanced Fenton performance of wet-mechanochemically synthesized FeS2/Biochar: The multiple synergistic effect derived from mutual element doping
3个月前
已采纳
Hydrogel microenvironment contributes to chemical-induced differentiation of mesenchymal stem cells: single-cell infrared microspectroscopy characterization
8个月前
已采纳
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