✦ LIBER ✦

Oligomer molecules: first-principles investigation of the optical properties and applications to luminescent devices

✍ Scribed by D. Pisignano; F. Della Sala; L. Persano; G. Gigli; R. Cingolani; G. Barbarella; L. Favaretto

Publisher: Elsevier Science
Year: 2004
Tongue: English
Weight: 231 KB
Volume: 339
Category: Article
ISSN: 0378-4371
DOI: 10.1016/j.physa.2004.03.050

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

First-principles investigations of the b

First-principles investigations of the band structure and optical properties of -boron

✍ Qinglin Xia; Jianhong Yi; Yanfeng Li; Yuandong Peng; Hongzhong Wang; Chengshang 📂 Article 📅 2010 🏛 Elsevier Science 🌐 English ⚖ 880 KB

We investigate the electronic structures, optical properties and perform a population analysis of the highpressure phase of boron (γ -B 28 ) by the norm-conserving pseudopotential density functional method. We employ the Perdew-Burke-Eruzerhof (PBE) form of the generalized gradient approximation (GG

First-Principles Calculation of Optical

First-Principles Calculation of Optical Properties: Application to Embedded Ge and Si Dots

✍ H.-C. Weissker; J. Furthmüller; F. Bechstedt 📂 Article 📅 2001 🏛 John Wiley and Sons 🌐 English ⚖ 93 KB 👁 2 views

First-principles investigation of the bo

First-principles investigation of the bonding, optical and lattice dynamical properties of CeO2

✍ Siqi Shi; Xuezhi Ke; Chuying Ouyang; Hua Zhang; Hangchen Ding; Yuanhao Tang; Wei 📂 Article 📅 2009 🏛 Elsevier Science 🌐 English ⚖ 761 KB

First-principles calculations of the str

First-principles calculations of the structural, electronic, and optical properties of LiF up to 300 GPa

✍ Zhi-Hong Sun; Jun Dong; Yan-Wen Xia 📂 Article 📅 2011 🏛 Elsevier Science 🌐 English ⚖ 882 KB

The structural, electronic, and optical properties of LiF are investigated at high pressures using the plane-wave pseudo-potential density functional method (DFT) within the generalized gradient approximation (GGA). From the analysis of Gibbs free energies, we find that no phase transition takes pla

Erratum to ‘‘First principles investigat

Erratum to ‘‘First principles investigation of electronic, optical and transport properties of α- and β-phase of Arsenic telluride” [Opt. Mater. 33 (2011) 899–904]

✍ Yamini Sharma; Pankaj Srivastava 📂 Article 📅 2011 🏛 Elsevier Science 🌐 English ⚖ 110 KB

Author has missed to include the following acknowledgement in the article. ''We are thankful to DRDO, New Delhi for providing financial assistance in form of major research project. We are grateful to Prof. P. Blaha and his team for the WIEN2 k code''.