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北京大学 [19]

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期刊论文 [19]

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限定条件	专题：北京大学第一署名单位第一作者单位通讯作者单位

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	Two-Coordinate Co(II) Imido Complexes as Outstanding Single Molecule Magnets 期刊论文 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2017 Yao, Xiao-Nan; Du, Jing-Zhen; Zhang, Yi-Quan; Leng, Xue-Bing; Yang, Mu-Wen; Jiang, Shang-Da; Wang, Zhen-Xing; Ouyang, Zhong-Wen; Deng, Liang; Wang, Bing-Wu; Gao, Song 收藏 \| 浏览/下载：4/0 \| 提交时间：2017/12/03 GAUSSIAN-BASIS SETS ION MAGNET LANTHANIDE COMPLEXES LIGATION SYNTHESIS ATOMS LI ANISOTROPY EXCHANGE COBALT(II) BLOCKING BEHAVIOR
	Robust ferromagnetism in monolayer chromium nitride 期刊论文 scientific reports, 2014 Zhang, Shunhong; Li, Yawei; Zhao, Tianshan; Wang, Qian 收藏 \| 浏览/下载：3/0 \| 提交时间：2015/11/10 BULK MODULUS TRANSITION CRN SHEETS GRAPHENE 1ST-PRINCIPLES SEMICONDUCTORS NANORIBBONS STABILITY NANOTUBES
	Investigation of the Spin Crossover Complex [Fe(bapbpy)(NCS)(2)] in Its Low-spin and High-spin State by DFT/TD-DFT/BS-DFT Calculations 期刊论文结构化学, 2013 Qu Yu-Hui; Li Le-Min 收藏 \| 浏览/下载：3/0 \| 提交时间：2015/11/13 spin crossover DFT vibrations and IR spectra excited states and UV/vis absorption spectra coupling constant values (J) DENSITY-FUNCTIONAL THEORY AB-INITIO MAGNETIC INTERACTION EXACT EXCHANGE ENERGY LIGHT SUPERCONDUCTIVITY APPROXIMATION AROMATICITY SPINTRONICS
	3d-4f Magnetic Interaction with Density Functional Theory Plus U Approach: Local Coulomb Correlation and Exchange Pathways 期刊论文 journal of physical chemistry a, 2013 Zhang, Yachao; Yang, Yang; Jiang, Hong 收藏 \| 浏览/下载：3/0 \| 提交时间：2015/11/10 TRANSITION-METAL-COMPLEXES TOTAL-ENERGY CALCULATIONS SINGLE-MOLECULE-MAGNET AB-INITIO CALCULATIONS AUGMENTED-WAVE METHOD COUPLING-CONSTANTS ELECTRONIC-STRUCTURE LDA+U METHOD PBE0 MODEL HUBBARD-U
	Constructing a Series of Azide-Bridged CuII Magnetic Low-Dimensional Coordination Polymers by using Pybox Ligands 期刊论文欧洲无机化学杂志, 2013 Zhu, Yuan-Yuan; Cui, Chang; Li, Ning; Wang, Bing-Wu; Wang, Zhe-Ming; Gao, Song 收藏 \| 浏览/下载：6/0 \| 提交时间：2015/11/10 Coordination polymers Copper N ligands Magnetic properties END-TO-END SINGLE-MOLECULE MAGNET COPPER(II) COMPLEXES CRYSTAL-STRUCTURES FERROMAGNETIC INTERACTION CHIRAL DICHROISM METAL-COMPLEXES CHAIN MAGNETS SCHIFF-BASE BEHAVIOR
	A new chloro-bridged Cu-II Schiff base complex with ferromagnetic exchange interaction 期刊论文欧洲无机化学杂志, 2007 Ma, Shu-Lan; Sun, Xu-Xia; Gao, Song; Qi, Chuan-Min; Huang, Hai-Bo; Zhu, Wen-Xiang 收藏 \| 浏览/下载：2/0 \| 提交时间：2015/11/12 copper Schiff bases dinuclear complex crystal structure magnetic properties BINUCLEAR COPPER(II) COMPLEXES MAGNETIC-PROPERTIES CRYSTAL-STRUCTURES MOLECULAR-STRUCTURE STRUCTURAL-CHARACTERIZATION DICHLORIDE DIHYDRATE DONOR GROUP(S) DIMERS LIGANDS HYDROXO
	Syntheses, crystal structures, and magnetic properties of two cyclic dimer M2L2 complexes constructed from a new nitronyl nitroxide ligand and M(hfac)(2) (M = Cu2+Mn2+) 期刊论文 inorganica chimica acta, 2007 Zhang, Jian-Ying; Liu, Cai-Ming; Zhang, De-Qing; Gao, Song; Zhu, Dao-Ben 收藏 \| 浏览/下载：5/0 \| 提交时间：2015/11/12 nitronyl nitroxide cyclic dimer complexes crystal structures magnetic properties TRANSITION-METAL DICATIONS ALTERNATING SPIN CHAINS COPPER(II) COMPLEXES COORDINATION-COMPLEXES IMINO NITROXIDE FREE-RADICALS FERROMAGNETIC INTERACTIONS CHELATING NITRONYL ORGANIC DIRADICALS MANGANESE(II)
	Unusual ferromagnetic coupling interaction in carboxylato-bridged Mn(II) complexes: Ab initio MRCI(SD) and DFT theoretical studies 期刊论文 journal of molecular structure theochem, 2007 Wang, Mingwel; Wang, Bingwu; Chen, Zhida 收藏 \| 浏览/下载：1/0 \| 提交时间：2015/11/12 Magnetic coupling Mn(II)-containing dimer Ab initio MRCI(SD) plus Q DFT broken-symmetry low-lying excited state DENSITY-FUNCTIONAL THEORY BROKEN SYMMETRY APPROACH MAGNETIC-PROPERTIES BINUCLEAR COMPLEXES MANGANESE CARBOXYLATE METAL DIMER EXCHANGE MOLECULE FAMILY INSULATORS
	Cyano-bridged Ln(3+)-Cr3+ binuclear complexes [Ln(L)(x)(H2O)(y)-Cr(CN)(6)]center dot mL center dot nH(2)O (Ln=La-Nd, x=5, y=2, m=1 or 2, n=2 or 2.5; Ln=Sm - Dy, Er, x=4, y=3, m=0, n=1.5 or 2.0; L=2-pyrrolidinone): Structure, magnetism and spin de 期刊论文中国化学英文版, 2007 Sun Xian-Ru; Chen Zhi-Da; Wang Ming-Wei; Wang Bing-Wu; Yan Feng; Cheung, Kung-Kai 收藏 \| 浏览/下载：2/0 \| 提交时间：2015/11/10 cyano-bridged compound 4f-3d magnetic coupling Ln-Cr spin density magnetic property CHROMIUM(III) NICKEL(II) CYANIDE REVERSED NEGATIVE MAGNETIZATION MOLECULAR-BASED MAGNETS CRYSTAL-STRUCTURE BIMETALLIC ASSEMBLIES NUMERICAL-INTEGRATION ELECTRONIC-STRUCTURE TEMPERATURE APPROXIMATION BEHAVIOR
	Heterometallic (MRu2III)-Ru-II compounds constructed from trans-[Ru(Salen)(CN)(2)](-) and trans-[Ru(AcaC)(2)(CN)(2)](-), synthesis, structures, magnetic properties, and density functional theoretical study 期刊论文 inorganic chemistry, 2005 Yeung, WF; Lau, PH; Lau, TC; Wei, HY; Sun, HL; Gao, S; Chen, ZD; Wong, WT 收藏 \| 浏览/下载：4/0 \| 提交时间：2015/11/12 BRIDGED BIMETALLIC COMPOUND SINGLE-MOLECULE MAGNETS CRYSTAL-STRUCTURE ORDERING TEMPERATURE COORDINATION POLYMERS SPIN REORIENTATION BUILDING-BLOCKS PRUSSIAN-BLUE MIXED-VALENCE DEGREES-C

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