Title of article :
LDA calculations of the Youngʹs moduli of polyethylene and six polyfluoroethylenes
Author/Authors :
Zhang، نويسنده , , M.-L. and Miao، نويسنده , , M.S. and Peeters، نويسنده , , A. and Van Alsenoy، نويسنده , , C. and Ladik، نويسنده , , J.J. and Van Doren، نويسنده , , V.E.، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2000
Abstract :
The Youngʹs moduli of the linear chain polymers, polyethylene and six polyfluoroethylenes, constrained to the planar conformation, are calculated by means of the local density approximation (LDA) using the Perdew–Zunger (PZ) correlation potential and a linear combination of Gaussian-type orbitals (LCGTO).
Keywords :
A. Polymers , D. Elasticity
Journal title :
Solid State Communications
Journal title :
Solid State Communications
