Chemical Structure from Scientific Research

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Charge density differences and Mulliken charge analysis in the constructed Au99.4Pt0.6NPs model containing a NO molecule adsorbed at the Pt top site. The cyan and blue contours represent the regions of electron accumulation and depletion, respectively. For 2D maps, the scale from red to blue was 0.1 to -0.1 e.
#Chemical Structure#Heatmap#Charge Density Differences#Mulliken Charge Analysis#Au99.4Pt0.6NPs Model#NO Molecule#Pt Top Site#Electron Accumulation#Electron Depletion
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