位置：成果数据库 > 期刊 > 期刊详情页
Mechanism of Ir(ppy)(2)(N N)(+) (N N=2-phenyl-1H-imidazo[4,5-f][1,10]phenanthroline) sensor for F-,
  • 时间：0
  • 相关项目：大气中瞬变物种的激发态位能面和光化学反应动力学的理论研究
同期刊论文项目
大气中瞬变物种的激发态位能面和光化学反应动力学的理论研究
期刊论文 82
同项目期刊论文
Dendritic tellurides acting as antioxidants
Theoretical studies upon the electronic structures and spectroscopic properties for a series of lumi
Isovalent gold(I), -(II), and -(III) and mixed-valent gold(I)/gold(III) phosphorus ylide complexes.
Theoretical studies on the structures and spectroscopic properties of rhenium(I) acetylide diimine c
DFT and TD-DFT calculations on the electronic structures and spectroscopic properties of cyclometala
Theoretical studies on spectroscopic properties of binuclear palladium(II) halide with phosphine lig
Ab initio study of the spectroscopy of (CH3)(3)CN and (CH3)(2)CHN
Substituent effect on the structures and luminescence of binuclearAu(I) complexes: An ab initio stud
Spectroscopic properties of mono- and binuclear platinum(II) alkynyl complexes with phosphine ligand
Theoretical studies on Ru(fppz)(2)(CO)L (L = N-heterocyclic ligand): Electronic structure, absorptio
C6H5N光谱性质的多组态二级微扰理论研究
FONO2低能激发态和光电子谱的理论研究
OClO里德堡态激发能的准确预测及其阴离子低能激发态的从头算研究
乙基硫自由基及阴、阳离子低电子激发态从头算研究
HSO自由基电子基态激发态的CAS计算研究
HO_2自由基电子激发态的理论研究
乙基溴及其阳离子的低能激发态从头算研究
Theoretical studies on [Ru(bpy)(2)(N boolean AND N)](2+) [N boolean AND N = hydrazone and azine]: Gr
Quantum chemistry study on electron structures and spectroscopic properties of monooxo- and dioxo-os
Theoretical studies on metal-metal interaction and spectroscopic properties of a series of hetero-bi
Electronic Structures and Spectroscopic Properties of Mono- and Binuclear d8 Complexes: A Theoretica
Theoretical Studies of the Electronic Structure and Spectroscopic Properties of [Ru(Htcterpy)(NCS)3]
Theoretical studies on structures and spectroscopic properties of a series of novel mixed-ligand Ir(
Theoretical studies on the electronic structures and optical properties of the oligomers involving b
A novel series of iridium complexes with alkenylquinoline ligands: Theoretical study on electronic s
Theoretical studies on the electronic structures and spectroscopic properties for a series of Osmium
Theoretical studies of the spectroscopic properties of blue emitting iridium complexes
Theoretical Studies on Structures and Spectroscopic Properties of Bis-Cyclometalated Iridium Complex
Computational Studies on the Spectroscopic Properties of the 2-Pyridylpyrazolate-Based Platinum(II)
Structures and electronic spectra of [Pt2(P2O5H2)4X2]4- (X = Cl, Br and I): A comparative study of a
Theoretical studies on electronic structures and spectroscopic properties of a series of novel beta-
A theoretical probe on the ground- and excited-state properties of heterobinuclear Au-Pt complex wit
Theoretical studies on square-planar pincer platinum(II) complex and its SO2 adducts: SO2 detector a
Electronic Structures and Spectroscopic Properties of [Pt(CNMe)2(CN)2]n (n = 1–4): A Theoretical Exp
Electronic structures and spectroscopic properties of nitrido-osmium(VI) complexes with acetylide li
Theoretical studies on structures and spectroscopic properties of a series of novel cationic [trans-
Theoretical studies on the structural and optical properties of a series of Os(II) diimine complexes
Theoretical studies on structures and spectroscopic properties of photoelectrochemical cell rutheniu
Theoretical studies of the electronic structures and optical properties of stable blue-emitting poly
多组态二级微扰理论计算CH3O2激发光谱以及CH3O2→CH3＋O2解离反应
Theoretical studies on the low-lying electronic states of the HSO neutral radical and its cation
Ab initio study of the spectroscopy of CH3N and CH3CH2N
A Theoretical Investigation of the Excited States of OClO Radical, Cation, and Anion using the CASSC
A study of the hydrogen abstraction reactions of C2H radical with CH3CN, C2H5CN, and C3H7CN by dual-
Theoretical Studies on Low-Lying Electronic States of Cyanocarbene HCCN and Its Ionic States
Theoretical studies of the spectroscopic properties of (L)Pt[(1,2-η2)-ph-(C≡C)n-ph] (L=dppp or (pph3
1-丁烯在MCM-22分子筛中的吸附与扩散：Monte Carlo与动力学模拟研究
双核Pt（Ⅱ）配合物的光谱结构和激发态性质的密度泛函理论研究
双核Au（I）磷硫配合物激发态性质和金属间弱相互作用的从头算研究
系列二亚胺Os（Ⅱ）配合物[Os（L）2（CN）2（phen）]（L=PH3，DMSO；phen=1，10-邻二氮杂菲）及[Os（PH3）2（phen）Br2]电子结构和光谱性质的理论研究
IrR（CO）（PH3）2（mnt）配合物的基态和激发态结构及光谱性质的理论研究
人类胞外信号调节激酶1的同源模建及其抑制剂的对接与结构改造
人类2-氨基3-羧基粘康酸6-半醛脱羧酶（ACMSD）与底物及抑制剂作用模型的理论研究
配合物[N,N′-二（亚水杨基）-1,2-乙二胺]Pt（Ⅱ）光谱性质的理论研究
联吡啶钌配合物[Ru（Htcterpy）X3]^3-[X=NCS,CN,Cl]的电子结构和光谱性质的理论研究
[Au（PH3）]^＋修饰下苯的激发态性质的理论研究
HO2自由基电子激发态的理论研究
人类丝氨酸消旋酶的同源模建及其与多肽类抑制剂的分子对接
吲哚咔唑异构体的电子结构和光学性质
噻吩分子及其与异辛烷二元混合物在MCM-22分子筛中吸附的蒙特卡罗模拟
一类[Os^（Ⅱ）（CO）3（tfa）（L）]（L=O^O，O^N，N^N）配合物的结构和光谱特征
d^8和d^10 配合物激发态性质和金属间弱相互作用的理论研究
Ru（Ⅱ）和Ru（Ⅲ）配合物[Ru（bpy）（PH3）（-C≡CC6H4N02-p）C1]^m（m=-O，＋1）的光谱性质的密度泛函-含时密度泛函理论研究
二氧化钛（TiO2）表面能的理论研究
三联吡啶Pt（Ⅱ）配合物的基态和激发态的理论研究
氮化锇配合物离子[OsN（mnt）2]-的电子结构和光谱性质的理论研究
[Au（PH3）]^＋修饰的芳香基炔基配合物发光机制的从头计算研究
二氧化钛（TiO2）表面上水分解反应的理论研究
双咔唑间连接方式不同引起的结构和性质变化的理论研究
[M（N）X2]-（M=Ru，Os；X=S2C6H4，mnt）的电子结构和光谱性质的理论研究
卤代氰基卡宾自由基XCCN（X=F，Cl，Br）的理论研究
基质金属蛋白酶的新型抑制剂效能的理论研究
分子动力学模拟1-丁烯和正丁烷在MCM-22分子筛中的扩散行为
具有Lindqvist结构的[Mo6O19]^2-化合物及其二钨取代物的电子性质和稳定性的理论研究
一系列d^8配合物^1,3[（dz^2）（Pz）]激发态和金属间相互作用的理论研究
Au（I）电荷转移配合物光谱性质的从头算研究
H2CCC光谱性质的从头算研究
含有共轭炔基的发光Pt（Ⅱ）配合物发光性质的密度泛函理论研究