✦ LIBER ✦

A density functional study on equilibrium geometries, stabilities and electronic properties of Au5Li binary clusters

✍ Scribed by Deka, Ajanta; Deka, Ramesh Chandra

Book ID: 118302306
Publisher: Springer-Verlag
Year: 2012
Tongue: English
Weight: 438 KB
Volume: 2
Category: Article
ISSN: 2190-5509
DOI: 10.1007/s13204-012-0092-x

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Geometries, stabilities, and magnetic pr

Geometries, stabilities, and magnetic properties of () clusters: Density functional theory study

✍ Die Dong; Xiao-Yu Kuang; Jian-Jun Guo; Ben-Xia Zheng 📂 Article 📅 2010 🏛 Elsevier Science 🌐 English ⚖ 648 KB

Geometries, stabilities and electronic p

Geometries, stabilities and electronic properties of small Nb-doped gallium clusters: A density functional theory study

✍ Shi Shun-Ping; Cao Yi-Ping; Zhai Ai-Ping; Li Yang; Jin Xing-Xing 📂 Article 📅 2011 🏛 Elsevier Science 🌐 English ⚖ 623 KB

The host Ga n þ 1 and doped Ga n Nb (n ¼ 1-9) clusters with several spin configurations have been systematically investigated by a relativistic density functional theory (DFT) with the generalized gradient approximation. The optimized equilibrium geometries tend to prefer the close-packed configurat

Geometries, stabilities, and electronic

Geometries, stabilities, and electronic properties of YnSi (n = 2–14) clusters: Density-functional theory investigations

✍ Wen-Jie Zhao; Bin Xu; Yuan-Xu Wang 📂 Article 📅 2011 🏛 Elsevier Science 🌐 English ⚖ 473 KB

Geometries, electronic and magnetic prop

Geometries, electronic and magnetic properties of hafnium clusters: A density functional calculation

✍ Run-Ning Zhao; Ju-Guang Han; Liu-Si Sheng 📂 Article 📅 2012 🏛 Elsevier Science 🌐 English ⚖ 610 KB

Density functional study on structures,

Density functional study on structures, stabilities, electronic and magnetic properties of NbnO (n=3–10) clusters

✍ Wang, Huai-Qian; Li, Hui-Fang 📂 Article 📅 2013 🏛 Elsevier 🌐 English ⚖ 682 KB

A DFT study on equilibrium geometries, s

A DFT study on equilibrium geometries, stabilities, and electronic properties of small bimetallic Na-doped Aun(n = 1-9) clusters: comparison with pure gold clusters

✍ Yan-Fang Li; Xiao-Yu Kuang; Ai-Jie Mao; Yang Li; Ya-Ru Zhao 📂 Article 📅 2011 🏛 Springer-Verlag 🌐 English ⚖ 490 KB