位置：成果数据库 > 期刊 > 期刊详情页
Ab initio investigation of hydrogenation of (BN)16: A comparison with that of (BN)12
  • 时间：0
  • 相关项目：新型氮氧无机团簇电子结构与热力学性质的研究
同期刊论文项目
新型氮氧无机团簇电子结构与热力学性质的研究
期刊论文 21
同项目期刊论文
Structure and Stability of Endohedral X@C60F, X@C60F2 (X = N, H), and (H@C60)2
First-principles study of structural, electronic and magnetic properties of Co13-nMn (n = 1, 2, M =
Structural, electronic and magnetic properties of ConRh (n=1–8) clusters from density functional cal
Density functional calculation on a high energy density compound having the formula C6H6-n(NO2)n.
A DFT Study on the Mechanism of the Coupling Reaction between Chloromethyloxirane and Carbon Dioxide
Structure and Stabilityof Tube and Cage Ge60H60
(BCO)12 与(CH)12 稳定性的环张力分析
Substituent and Solvent Effects on Electronic Structure and Spectral Property of ReCl(CO)3(NN) (NN =
A Computational Study on the Chemical Fixation of Carbon Dioxide with Epoxide Catalyzed by LiBr Salt
Ligand Effects on Structures and Spectroscopic Propertiesof Pyridine-2-aldoxime Complexes of Re(CO)3
Ab initio investigation of hydrogenation of endohedral X@(BN)16 complexes (X = Li+, Na+, K+, Mg2+, N
A computational study on the chemical fixation of carbon dioxide with 2-aminobenzonitrile catalyzed
Quantum Chemical Study of C(n)Al(2)(+/-) (n=1 similar to 10) Clusters: Structure and Stability
Theoretical calculation about the valence and rydberg excited states of hydrogen cyanide.
CnAl+小团簇结构的几何特征与稳定性
C_nAl_m~＋（n=1～12,m=1,2）团簇几何结构特征与稳定性的量子化学研究
AlnO2团簇结构和稳定性的量子化学研究
CnAl^＋小团簇结构的几何特征与稳定性
AlnO2^±团簇结构的几何特征与稳定性
（BCO）12与（CH）12稳定性的环张力分析