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浏览/检索结果: 共12条，第1-10条 帮助 限定条件 专题：福建物质结构研究所    第一署名单位    第一作者单位    通讯作者单位     已选(0)清除 条数/页：5101520253035404550556065707580859095100   排序方式：请选择作者升序作者降序题名升序题名降序发表日期升序发表日期降序提交时间升序提交时间降序 Tetratungsten Oxide Clusters W4On-/0 (n=10-13): Structural Evolution and Chemical Bonding 期刊论文 Journal of Physical Chemistry A, 2010, 卷号: 114, 期号: 4, 页码: 1964-1972 B. Wang, W. J. Chen, B. C. Zhao, Y. F. Zhang and X. Huang 收藏  |  浏览/下载：44/0  |  提交时间：2012/11/02 tungsten-oxide  gas-phase  photoelectron-spectroscopy  electronic-structure  basis-sets  ab-initio  infrared-spectroscopy  molecular-oxygen  dft calculations  trimer cluster   Structural Evolution, Sequential Oxidation, and Chemical Bonding in Tritantalum Oxide Clusters: Ta3On- and Ta3On (n=1-8) 期刊论文 Journal of Physical Chemistry A, 2009, 卷号: 113, 期号: 36, 页码: 9804-9813 H. J. Zhai, B. Wang, X. Huang and L. S. Wang 收藏  |  浏览/下载：13/0  |  提交时间：2012/11/06 supported tantalum oxide  d-orbital aromaticity  valence basis-sets  ab-initio pseudopotentials  transition-metal clusters  core model  potentials  photoelectron-spectroscopy  electronic-structure  quintuple  bond  catalytic-properties   Structural Evolution, Sequential Oxidation, and Chemical Bonding in Tritantalum Oxide Clusters: Ta3On- and Ta3On (n=1-8) 期刊论文 Journal of Physical Chemistry A, 2009, 卷号: 113, 期号: 36, 页码: 9804-9813 H. J. Zhai, B. Wang, X. Huang and L. S. Wang 收藏  |  浏览/下载：14/0  |  提交时间：2012/11/06 supported tantalum oxide  d-orbital aromaticity  valence basis-sets  ab-initio pseudopotentials  transition-metal clusters  core model  potentials  photoelectron-spectroscopy  electronic-structure  quintuple  bond  catalytic-properties   Chemical bonding, electronic, and magnetic properties of R3Co4Sn13 intermetallics (R=La, Ce, Sm, Gd, and Tb): Density functional calculations 期刊论文 Physical Review B, 2009, 卷号: 79, 期号: 9 G. H. Zhong, X. W. Lei and J. G. Mao 收藏  |  浏览/下载：12/0  |  提交时间：2012/11/06 antiferromagnetic materials  band structure  bonds (chemical)  cerium  alloys  cobalt alloys  density functional theory  Fermi surface  ferromagnetic materials  gadolinium alloys  lanthanum alloys  magnetic  moments  samarium alloys  terbium alloys  tin alloys  type II  superconductors  brillouin-zone integrations  crystal-structure  rare-earth  ybrhsn  metals  transitions  ce3ir4sn13  stannides  transport  behavior   Chemical bonding, electronic, and magnetic properties of R3Co4Sn13 intermetallics (R=La, Ce, Sm, Gd, and Tb): Density functional calculations 期刊论文 Physical Review B, 2009, 卷号: 79, 期号: 9 G. H. Zhong, X. W. Lei and J. G. Mao 收藏  |  浏览/下载：16/0  |  提交时间：2012/11/06 antiferromagnetic materials  band structure  bonds (chemical)  cerium  alloys  cobalt alloys  density functional theory  Fermi surface  ferromagnetic materials  gadolinium alloys  lanthanum alloys  magnetic  moments  samarium alloys  terbium alloys  tin alloys  type II  superconductors  brillouin-zone integrations  crystal-structure  rare-earth  ybrhsn  metals  transitions  ce3ir4sn13  stannides  transport  behavior   Theoretical studies on the bonding of Cd2+ to adenine and thymine: Tautomeric equilibrium and metalation in base pairing 期刊论文 Chemical Physics Letters, 2009, 卷号: 467, 期号: 4-6, 页码: 387-392 Y. Wu, R. J. Sa, Q. H. Li, Y. Q. Wei and K. C. Wu 收藏  |  浏览/下载：10/0  |  提交时间：2012/11/06 stabilized rare tautomers  nucleic-acid bases  modified nucleobase  pairs  ab-initio  watson-crick  gas-phase  dna  cytosine  ions  binding   Theoretical studies on the bonding of Cd2+ to adenine and thymine: Tautomeric equilibrium and metalation in base pairing 期刊论文 Chemical Physics Letters, 2009, 卷号: 467, 期号: 4-6, 页码: 387-392 Y. Wu, R. J. Sa, Q. H. Li, Y. Q. Wei and K. C. Wu 收藏  |  浏览/下载：9/0  |  提交时间：2012/11/06 stabilized rare tautomers  nucleic-acid bases  modified nucleobase  pairs  ab-initio  watson-crick  gas-phase  dna  cytosine  ions  binding   On the Electronic Structure and Chemical Bonding in the Tantalum Trimer Cluster 期刊论文 Journal of Physical Chemistry A, 2008, 卷号: 112, 期号: 43, 页码: 10962-10967 B. Wang; H. J. Zhai; X. Huang and L. S. Wang 收藏  |  浏览/下载：12/0  |  提交时间：2013/01/22 density-functional theory  d-orbital aromaticity  transition-metal  clusters  ab-initio calculations  photoelectron-spectroscopy  oxide  clusters  quintuple bond  ionization-potentials  carbide clusters  boron  clusters   New organically ternplated copper(I) sulfites: the role of sulfite anion as both soft and hard ligand 期刊论文 Inorganic Chemistry, 2007, 卷号: 46, 期号: 20, 页码: 8302-8308 P. X. Li; H. L. Jiang; M. L. Fengt; J. G. Mao 收藏  |  浏览/下载：11/0  |  提交时间：2013/04/01 crystal-structure  structural-characterization  different  dimensionalities  metal phosphates  complexes  selenites  clusters  series  ta5+  nb5+   Synthesis, crystal structure and spectral properties of Fe-3(2,2'-bipy)(6)(ox)(3) center dot 12.25H(2)O complex 期刊论文 Journal of Chemical Crystallography, 2007, 卷号: 37, 期号: 10, 页码: 651-654 X. Wang; Y. H. Xu; X. Y. Song; L. Li; D. Z. Liao; Z. H. Jiang; S. P. Yan 收藏  |  浏览/下载：19/0  |  提交时间：2013/04/01 crystal structure  2  iron(II) complex  2'-bipy  hydrogen bonding  dinuclear copper(ii) complexes  magnetic-properties  oxalato  ligand