TY - JOUR
T1 - Ferroelectric PVDF films and graphene-based composites
AU - Bystrov, Vladimir
AU - Bdikin, Igor
AU - Silibin, Maxim
AU - Meng, Xiangjian
AU - Tian, Bobo
AU - Wang, Jianlu
AU - Karpysky, Dmitry
AU - Bystrova, Anna
AU - Paramonova, Ekaterina
N1 - Publisher Copyright:
© Published under licence by IOP Publishing Ltd.
PY - 2018/7/26
Y1 - 2018/7/26
N2 - Advantages in the studies of new composite nanomaterials based on polymer ferroelectrics and graphene are presented. We analyzed the main results of the computational molecular modeling of nanostructures and the pyroelectric properties of the composites from polyvinylidene fluoride (PVDF) films and graphene layers. The pyroelectric effect was modelled and pyroelectric coefficients were calculated for several models using molecular dynamics simulation with quantum-chemical semi-empirical PM3 method from HyperChem tool. The results obtained provide important insights into our understanding of the mechanisms of pyroelectricity in the new nanocomposites, give us new prospective for further studies of the ferroelectric polymer-graphene multifunctional nanomaterials.
AB - Advantages in the studies of new composite nanomaterials based on polymer ferroelectrics and graphene are presented. We analyzed the main results of the computational molecular modeling of nanostructures and the pyroelectric properties of the composites from polyvinylidene fluoride (PVDF) films and graphene layers. The pyroelectric effect was modelled and pyroelectric coefficients were calculated for several models using molecular dynamics simulation with quantum-chemical semi-empirical PM3 method from HyperChem tool. The results obtained provide important insights into our understanding of the mechanisms of pyroelectricity in the new nanocomposites, give us new prospective for further studies of the ferroelectric polymer-graphene multifunctional nanomaterials.
UR - https://www.scopus.com/pages/publications/85051378216
U2 - 10.1088/1742-6596/1053/1/012043
DO - 10.1088/1742-6596/1053/1/012043
M3 - 会议文章
AN - SCOPUS:85051378216
SN - 1742-6588
VL - 1053
JO - Journal of Physics: Conference Series
JF - Journal of Physics: Conference Series
IS - 1
M1 - 012043
T2 - 1st International Conference on Physics, Mathematics and Statistics, ICPMS 2018
Y2 - 12 May 2018 through 14 May 2018
ER -