机构

• 福建物质结构研究所 [12]
• 物理研究所 [4]
• 长春应用化学研究所 [3]
• 宁波材料技术与工程研... [1]
• 化学研究所 [1]
• 上海应用物理研究所 [1]
• 更多

采集方式

• OAI收割 [22]

内容类型

• 期刊论文 [21]
• 会议论文 [1]

发表日期

• 2019 [1]
• 2015 [1]
• 2013 [1]
• 2010 [2]
• 2009 [5]
• 2008 [5]
• 更多

学科主题

• Chemistry [1]

筛选

浏览/检索结果: 共22条，第1-10条 帮助 条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择题名升序题名降序提交时间升序提交时间降序作者升序作者降序发表日期升序发表日期降序 A dual approach to study the synthesis, crystal structure and nonlinear optical properties of binuclear Pd(II) complex of 3-methyl-5-(trifluoromethyl) pyrazole and its potential quantum chemical analogues 期刊论文  OAI收割 INORGANICA CHIMICA ACTA, 2019, 卷号: 494, 页码: 160-167 作者:  Muhammad, S;  Hussain, S;  Chen, XN;  Al-Sehemi, AG;  Li, ZJ   |  收藏  |  浏览/下载：102/0  |  提交时间：2020/10/16 PALLADIUM COMPLEXES  MOLECULAR CALCULATIONS  ABSOLUTE HARDNESS  TRANSITION  HYPERPOLARIZABILITIES  DERIVATIVES  DINUCLEAR  EFFICIENT  COPPER(I)  ENERGIES   Push-Pull Type Oligo(N-annulated perylene)quinodimethanes: Chain Length and Solvent-Dependent Ground States and Physical Properties 会议论文  OAI收割 作者:  Zeng, Zebing;  Lee, Sangsu;  Son, Minjung;  Fukuda, Kotaro;  Mayorga Burrezo, Paula   |  收藏  |  浏览/下载：18/0  |  提交时间：2021/12/02 NONLINEAR-OPTICAL PROPERTIES  EXTENDED P-QUINODIMETHANES  OPEN-SHELL  2ND HYPERPOLARIZABILITIES  QUINOIDAL OLIGOTHIOPHENES  DIRADICAL CHARACTER  BIRADICAL CHARACTERS  2-PHOTON ABSORPTION  ELECTRON-ACCEPTORS  CLOSED-SHELL   The structure and large nonlinear optical properties of a novel octupolar electride Li@3(6)Adz 期刊论文  OAI收割 computational and theoretical chemistry, 2013, 卷号: 1023, 页码: 99-103 Zhou ZJ; Li H; Huang XR; Wu ZJ; Ma F; Li ZR 收藏  |  浏览/下载：31/0  |  提交时间：2014/04/15 SUBSTITUTED CONJUGATED MOLECULES  BOND-LENGTH ALTERNATION  METAL-COMPLEXES  COORDINATION NETWORKS  1ST HYPERPOLARIZABILITIES  2ND-ORDER  ALKALIDES  LI  NA  1ST-HYPERPOLARIZABILITY   Theoretical Studies on Electronic Structures and Second-order Polarizabilities of Thiazole Derivatives 期刊论文  OAI收割 CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE, 2010, 卷号: 31, 期号: 2, 页码: 357 Tan, H; Ma, XH; Liang, R; Ai, XC; Sun, MT; Zhang, JP 收藏  |  浏览/下载：36/0  |  提交时间：2013/09/23 NONLINEAR-OPTICAL PROPERTIES  MOLECULAR HYPERPOLARIZABILITIES  DIPOLE-MOMENT  EXCITED-STATE  CHROMOPHORES   Push-pull electron effects of the complexant in a Li atom doped molecule with electride character: a new strategy to enhance the first hyperpolarizability 期刊论文  OAI收割 physical chemistry chemical physics, 2010, 卷号: 12, 期号: 35, 页码: 10562-10568 Liu ZB; Zhou ZJ; Li Y; Li ZR; Wang R; Li QZ; Li Y; Jia FY; Wang YF; Li ZJ; Cheng JB; Sun CC 收藏  |  浏览/下载：29/0  |  提交时间：2012/04/26 NONLINEAR-OPTICAL PROPERTIES  HYPER-RAYLEIGH SCATTERING  DONOR-ACCEPTOR POLYENES  AB-INITIO  STATIC 1ST  2ND HYPERPOLARIZABILITIES  NLO RESPONSES  DIPOLE-MOMENT  2ND-ORDER  ALKALIDES   A New Hybrid DFT Approach to Electronic Excitation and First Hyperpolarizabilities of Transition Metal Complexes 期刊论文  OAI收割 Journal of Computational Chemistry, 2009, 卷号: 30, 期号: 13, 页码: 2056-2063 J. Lin, K. C. Wu and M. X. Zhang 收藏  |  浏览/下载：23/0  |  提交时间：2012/11/06 hybrid exchange functional  organometallic molecule  conventional  density functional  optical property  nonlinear-optical properties  generalized-gradient-approximation  density-functional theory  quadratic hyperpolarizabilities  organometallic complexes  dipole-moment  exchange functionals  correlation energies  carbonyl-complexes  acceptor groups   Solvent effect on quadratic hyperpolarizability of 4-(dimethylamino-4 '-stilbazole)tungsten pentacarbonyl: A revisit of mechanism for second-order response 期刊论文  OAI收割 Chemical Physics Letters, 2009, 卷号: 471, 期号: 4-6, 页码: 229-233 Q. H. Li, K. C. Wu, R. J. Sa and Y. Q. Wei 收藏  |  浏览/下载：25/0  |  提交时间：2012/11/06 nonlinear-optical properties  exchange-correlation potentials  correct  asymptotic-behavior  transition-metal-complexes  density-functional  theory  1st hyperpolarizabilities  chromophores  charge  approximation  conformation   Relative stability and optical nonlinearity of multiple conformers of 1,1'-substituted ferrocenes 期刊论文  OAI收割 Molecular Physics, 2009, 卷号: 107, 期号: 13, 页码: 1323-1329 C. Y. Mang, C. P. Liu, J. Q. Zi, J. Zhou, X. Zhao and K. C. Wu 收藏  |  浏览/下载：22/0  |  提交时间：2012/11/06 ferrocene  hyperpolarizability  ab initio calculation  pi-pi interaction  hybrid supramolecular arrays  sesquifulvalene complexes  1st  hyperpolarizabilities  2nd hyperpolarizability  crystal-structures  chromophores  dipyridines  acids  dft   Second-order nonlinear optical properties of transition metal clusters MoS4Cu4X2Py2 (M = Mo, W; X = Br, I) 期刊论文  OAI收割 Physical Chemistry Chemical Physics, 2009, 卷号: 11, 期号: 22, 页码: 4490-4497 Q. H. Li, K. C. Wu, Y. Q. Wei, R. J. Sa, Y. P. Cui, C. G. Lu, J. Zhu and J. G. He 收藏  |  浏览/下载：19/0  |  提交时间：2012/11/06 density-functional theory  heteronuclear bimetallic complexes  ruthenium(ii) ammine complexes  correct asymptotic-behavior  order  regular approximation  hyper-rayleigh scattering  electron  molecular-system  quadratic hyperpolarizabilities  1st  hyperpolarizabilities  heterothiometallic clusters   TDDFT Study on the Electronic Excitations and First Hyperpolarizabilities of Mixed-metal Carbonyl Clusters W2Ir2(mu-L)(CO)(8) (eta(5)-C5H4Me)(2)(L = dppe/dppf) 期刊论文  OAI收割 Chinese Journal of Structural Chemistry, 2009, 卷号: 28, 期号: 1, 页码: 99-105 F. J. Li, R. J. Sa and K. C. Wu 收藏  |  浏览/下载：17/0  |  提交时间：2012/11/06 TDDFT  UV-vis spectrum  transition metal  nonlinear optical  quadratic hyperpolarizabilities  optical nonlinearities  nlo responses  complexes  chemistry