Search Results - "Pei, Q. X."
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A molecular dynamics study of the mechanical properties of hydrogen functionalized graphene
Published in Carbon (New York) (01-03-2010)“…Molecular dynamics simulations have been performed to investigate the mechanical properties of hydrogen functionalized graphene for H-coverages spanning the…”
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2
Concentration and risk assessment of phthalates present in indoor air from newly decorated apartments
Published in Atmospheric environment (1994) (01-04-2013)“…Phthalate esters (PAEs) are ubiquitous in the indoor environment, owing to their use in consumer products. People spend a considerable amount of time indoors…”
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3
Atomistic-scale analysis of the deformation and failure of polypropylene composites reinforced by functionalized silica nanoparticles
Published in Scientific reports (29-11-2021)“…Interfacial adhesion between polymer matrix and reinforcing silica nanoparticles plays an important role in strengthening polypropylene (PP) composite. To…”
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MFC-structured biodegradable poly(l-lactide)/poly(butylene adipate-co-terephatalate) blends with improved mechanical and barrier properties
Published in Journal of materials science (01-09-2013)“…Both polylactide (PLA) and poly(butylene adipate- co -terephthalate) (PBAT) are biodegradable polymers. They are thermoplastics which can be processed using…”
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5
Effect of cooling rate on the structure and nanotribology of Ag–Cu nano-eutectic alloys
Published in Journal of materials science (01-06-2019)“…Wear mechanisms of three Ag–Cu eutectic alloy samples cooled at different rates from the melt have been investigated by friction force microscopy. The eutectic…”
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Molecular Dynamics Simulations on the Frictional Behavior of a Perfluoropolyether Film Sandwiched between Diamond-like-Carbon Coatings
Published in Langmuir (18-02-2014)“…We perform molecular dynamics simulations to investigate the nanoscale frictional behavior of a perfluoropolyether (PFPE) film sandwiched between two…”
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7
Large scale molecular dynamics study of nanometric machining of copper
Published in Computational materials science (01-12-2007)“…Nanometric machining involves removal of materials at the order of a few nanometers or less. At such a small length scale, molecular dynamics (MD) simulation…”
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Nanometric cutting of copper: A molecular dynamics study
Published in Computational materials science (01-10-2006)“…Molecular dynamics (MD) simulations were carried out to study the nanometric cutting of copper. In our approach, the many-body EAM potential was used for the…”
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9
Mechanical properties of graphynes under tension: A molecular dynamics study
Published in Applied physics letters (20-08-2012)“…Graphyne is the allotrope of graphene. In this letter, four different graphynes ( alpha , beta , gamma , and 6,6,12-graphenes) are investigated by molecular…”
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Study of Materials Deformation in Nanometric Cutting by Large-scale Molecular Dynamics Simulations
Published in Nanoscale research letters (01-05-2009)“…Nanometric cutting involves materials removal and deformation evolution in the surface at nanometer scale. At this length scale, atomistic simulation is a very…”
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11
Effects of grain size and temperature on mechanical and failure properties of ultrananocrystalline diamond
Published in Diamond and related materials (01-11-2011)“…Molecular dynamics simulations of ultrananocrystalline diamond (UNCD), with random distribution of grain sizes and grain boundaries (GBs), are performed to…”
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12
Contrast-enhanced ultrasonography of hepatocellular carcinoma: correlation between quantitative parameters and histological grading
Published in British journal of radiology (01-09-2012)“…The quantitative parameters in the contrast-enhanced ultrasonography time-intensity curve of hepatocellular carcinoma (HCC) were studied to explore their…”
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13
Molecular dynamics study on DNA oligonucleotide translocation through carbon nanotubes
Published in The Journal of chemical physics (28-09-2008)“…Molecular dynamics simulations are performed to study the translocation of a DNA oligonucleotide in a carbon nanotube (CNT) channel consisting of CNTs of two…”
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14
Tribological properties of MoS2 and carbon fiber reinforced polyimide composites
Published in Journal of materials science (01-07-2008)“…The tribological properties of carbon fiber reinforced polyimide (PI) composites with different MoS 2 containing sliding against GCr15 steel were comparatively…”
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15
Effect of N2O on high-rate homoepitaxial growth of CVD single crystal diamonds
Published in Journal of crystal growth (15-07-2012)“…Various gases such as N2, O2, and CO2 have been introduced in the typical reaction atmosphere of CH4/H2 and proposed to improve the growth of chemical vapor…”
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Effects of grain size, temperature and strain rate on the mechanical properties of polycrystalline graphene – A molecular dynamics study
Published in Carbon (New York) (01-04-2015)“…We investigate the mechanical properties of polycrystalline graphene deforming under uniaxial tension by using molecular dynamics simulations, focusing on the…”
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Ab initio study on the electronic origin of glass-forming ability in the binary Cu–Zr and the ternary Cu–Zr–Al(Ag) metallic glasses
Published in Journal of alloys and compounds (15-01-2015)“…It is believed that the basic local cluster in metallic glasses (MGs) is the key to understand the origin of glass-forming ability (GFA) of MGs. Our ab initio…”
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A molecular dynamics investigation on thermal conductivity of graphynes
Published in Computational materials science (01-12-2012)“…► Thermal conductivity (TC) of four different graphyne structures is investigated. ► TC of graphynes are lower than that of graphene because of the acetylenic…”
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Thermal conductivity of defective graphene
Published in Physics letters. A (01-11-2012)“…In this Letter, the thermal conductivity of defective graphene is investigated by using non-equilibrium molecular dynamics simulations. It is found that…”
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Haemodynamic parameters of the hepatic artery and vein can detect liver metastases : assessment using contrast-enhanced ultrasound
Published in British journal of radiology (01-02-2008)“…This study was to assess the changes in the haemodynamic parameters of the hepatic artery and vein in the diagnosis of liver metastases by contrast-enhanced…”
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