✦ LIBER ✦

A Theoretical Study of the Electronic and Optical Properties of the Graphite Intercalation Compound K(NH 3 ) 4 C 24

✍ Scribed by Bernasconi, Leonardo; Madden, Paul A.

Book ID: 127130963
Publisher: American Chemical Society
Year: 2002
Tongue: English
Weight: 795 KB
Volume: 106
Category: Article
ISSN: 0022-3654
DOI: 10.1021/jp020946q

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Theoretical prediction of the structural

Theoretical prediction of the structural, elastic, electronic and optical properties of Zr3N4 and Hf3N4 compounds

✍ T. Chihi; M. Fatmi; B. Ghebouli; M. Guemmaz 📂 Article 📅 2011 🏛 Elsevier Science 🌐 English ⚖ 572 KB

Theoretical study of the electronic stru

Theoretical study of the electronic structure, chemical bonding and optical properties of KNbO 3 in the paraelectric cubic phase

✍ Okoye, C M I 📂 Article 📅 2003 🏛 Institute of Physics 🌐 English ⚖ 320 KB

Theoretical Studies of the Modulation of

Theoretical Studies of the Modulation of Polymer Electronic and Optical Properties through the Introduction of the Electron-Donating 3,4-Ethylenedioxythiophene or Electron-Accepting Pyridine and 1,3,4-Oxadiazole Moieties

✍ Yang, Li; Liao, Yi; Feng, Ji-Kang; Ren, Ai-Min 📂 Article 📅 2005 🏛 American Chemical Society 🌐 English ⚖ 417 KB

Theoretical prediction of the structural

Theoretical prediction of the structural and electronic properties of pseudocubic X3As4 (X=C, Si, Ge and Sn) compounds

✍ Z. Charifi; H. Baaziz; B. Hamad 📂 Article 📅 2009 🏛 Elsevier Science 🌐 English ⚖ 444 KB

The structural and electronic properties of X 3 As 4 (X ¼ C, Si, Ge and Sn) compounds were investigated using density functional theory (DFT) calculations. We employed both the generalized-gradient approximation (GGA), which is based on exchange-correlation energy optimization to calculate the total

Theoretical studies on the electronic sp

Theoretical studies on the electronic spectra and second-order nonlinear optical properties of N-methyl-2-(2′-thiophene)-pyrrolo[3,4]C60

✍ Yongjun Liu; Dongju Zhang; Haiquan Hu; Chengbu Liu 📂 Article 📅 2001 🏛 Elsevier Science 🌐 English ⚖ 170 KB

Ab initio study of the structural, elect

Ab initio study of the structural, electronic and optical properties of the fluoropervskite SrXF3 (X=Li, Na, K and Rb) compounds

✍ Mubarak, A.A. 📂 Article 📅 2014 🏛 Elsevier Science 🌐 English ⚖ 765 KB