Atomistic simulations of aromatic polyurea and polyamide for capacitive energy storage

Optimizing nanostructure to achieve high dielectric response with low loss in strongly dipolar polymers

(2015) Yash Thakur et al.   Nano Energy

Meta-aromatic polyurea with high dipole moment and dipole density for energy storage capacitors

(2014) Shan Wu et al.   APPLIED PHYSICS LETTERS

Semicrystalline polymers with high dielectric constant, melting temperature, and charge-discharge efficiency

(2014) Shihai Zhang et al.   IEEE TRANSACTIONS ON DIELECTRICS AND ELECTRICAL INSULATION

Aromatic Polythiourea Dielectrics with Ultrahigh Breakdown Field Strength, Low Dielectric Loss, and High Electric Energy Density

(2013) Shan Wu et al.   ADVANCED MATERIALS

Novel Ferroelectric Polymers for High Energy Density and Low Loss Dielectrics

(2012) Lei Zhu et al.   MACROMOLECULES

Electric Field Induced Phase Transitions in Polymers: A Novel Mechanism for High Speed Energy Storage

(2012) V. Ranjan et al.   PHYSICAL REVIEW LETTERS

ReaxFF-lg: Correction of the ReaxFF Reactive Force Field for London Dispersion, with Applications to the Equations of State for Energetic Materials

(2011) Lianchi Liu et al.   JOURNAL OF PHYSICAL CHEMISTRY A

A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

(2010) Stefan Grimme et al.   JOURNAL OF CHEMICAL PHYSICS

High-energy density in aromatic polyurea thin films

(2009) Yong Wang et al.   APPLIED PHYSICS LETTERS

Electrical breakdown and ultrahigh electrical energy density in poly(vinylidene fluoride-hexafluoropropylene) copolymer

(2009) Xin Zhou et al.   APPLIED PHYSICS LETTERS

QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials

(2009) Paolo Giannozzi et al.   JOURNAL OF PHYSICS-CONDENSED MATTER