مرکز منطقه ای اطلاع رساني علوم و فناوري - Non-periodic finite-element formulation of orbital-free density functional theory

Title of article :

Non-periodic finite-element formulation of orbital-free density functional theory

Author/Authors :

Vikram Gavini، نويسنده , , Jaroslaw Knap، نويسنده , , Kaushik Bhattacharya ، نويسنده , , Michael Ortiz، نويسنده ,

Issue Information :

روزنامه با شماره پیاپی سال 2007

Pages :

From page :

669

To page :

696

Keywords :

Finite elements , Variational calculus , G-convergence , Density functional theory (DFT)

Journal title :

Journal of the Mechanics and Physics of Solids

Serial Year :

2007

Journal title :

Journal of the Mechanics and Physics of Solids

Record number :

355016

Link To Document :