Atomistic investigation of functionalized polyethylene-alumina interfacial strength and tensile behaviour

作者: Pär A.T. Olsson , Erik Bergvall

DOI: 10.1016/J.COMMATSCI.2020.110075

关键词:

摘要: … work, we use the open-source LAMMPS software [26]. For … H repulsion to describe the internal friction within the united-atom … tensile modelling of pure PE using PCFF and OPLS-AA and …

参考文章(60)
P. Thissen, G. Grundmeier, S. Wippermann, W. G. Schmidt, Water adsorption on the α -Al 2 O 3 ( 0001 ) surface Physical Review B. ,vol. 80, pp. 245403- ,(2009) , 10.1103/PHYSREVB.80.245403
John D. Spikes, Photodegradation of Foods and Beverages Photochemical and Photobiological Reviews. pp. 39- 85 ,(1981) , 10.1007/978-1-4684-7003-1_2
G. Grundmeier, P. Thissen, S. Wippermann, Wolf Gero Schmidt, Water adsorption on the α-Al2O3(0001) surface Physical Review B. ,vol. 80, ,(2009)
MIRAY BEKBÖLET, Light Effects on Food. Journal of Food Protection. ,vol. 53, pp. 430- 440 ,(1990) , 10.4315/0362-028X-53.5.430
Øyvind Borck, Per Hyldgaard, Elsebeth Schröder, Adsorption of methylamine on α − Al 2 O 3 ( 0001 ) and α − Cr 2 O 3 ( 0001 ) : Density functional theory Physical Review B. ,vol. 75, pp. 035403- ,(2007) , 10.1103/PHYSREVB.75.035403
Jianyang Wu, Shijo Nagao, Zhiliang Zhang, Jianying He, Deformation and fracture of nano-sized metal-coated polymer particles: A molecular dynamics study Engineering Fracture Mechanics. ,vol. 150, pp. 209- 221 ,(2015) , 10.1016/J.ENGFRACMECH.2015.08.028
Z. Łodziana, J. K. Nørskov, P. Stoltze, The stability of the hydroxylated (0001) surface of α-Al2O3 The Journal of Chemical Physics. ,vol. 118, pp. 11179- 11188 ,(2003) , 10.1063/1.1574798
Xiao-Gang Wang, Anne Chaka, Matthias Scheffler, Effect of the environment on alpha-Al_2O_3 (0001) surface structures Physical Review Letters. ,vol. 84, pp. 3650- 3653 ,(2000) , 10.1103/PHYSREVLETT.84.3650
T. J. Godin, John P. LaFemina, Atomic and electronic structure of the corundum (α-alumina) (0001) surface Physical Review B. ,vol. 49, pp. 7691- 7696 ,(1994) , 10.1103/PHYSREVB.49.7691
Øyvind Borck, Elsebeth Schröder, First-principles study of the adsorption of methanol at the α-Al2O3(0001) surface Journal of Physics: Condensed Matter. ,vol. 18, pp. 1- 12 ,(2006) , 10.1088/0953-8984/18/1/001