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Data · dataset · 2026

Friction barrier of heteroatom-doped graphene

Listed in ScienceDB

Based on the self-developed first principles based high-throughput calculation platform for solid interface frictional properties (LICP-FPHTC Platform), the entire process of modeling and data processing has been automated.

Description

In the LICP-FPHTC Platform, first principles calculations are performed using the Vienna de novo simulation package (VASP) within the density functional theory (DFT) framework. This dataset contains the frictional potential barriers of heteroatom doped graphene at different concentrations and interlayer spacings. 

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Where it is published

Catalogue records · 1

Topics

Inferred from text
Density functional theory 75% · Simulation 75%

Related

Provenance · 1 source records, 12 field assertions
SourceKeyLast seenRaw
ScienceDB10.57760/sciencedb.licpdata.000398 d agoJSON v1
FieldAssertionExtractorEvidence
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