中国科学院机构知识库网格
Chinese Academy of Sciences Institutional Repositories Grid
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CAS IR Grid
机构
大连化学物理研究所 [17]
福建物质结构研究所 [2]
上海应用物理研究所 [1]
中国科学院大学 [1]
长春应用化学研究所 [1]
采集方式
OAI收割 [20]
iSwitch采集 [2]
内容类型
期刊论文 [22]
发表日期
2019 [3]
2018 [1]
2016 [2]
2010 [2]
2008 [1]
2007 [1]
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学科主题
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浏览/检索结果:
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Probing solvation and reactivity in ionized polycyclic aromatic hydrocarbon-water clusters with photoionization mass spectrometry and electronic structure calculations
期刊论文
OAI收割
FARADAY DISCUSSIONS, 2019, 卷号: 217, 页码: 414-433
作者:
Xu, Bo
;
Stein, Tamar
;
Ablikim, Utuq
;
Jiang, Ling
;
Hendrix, Josie
  |  
收藏
  |  
浏览/下载:47/0
  |  
提交时间:2019/12/02
A theoretical investigation on the structures of (NH3)center dot(H2SO4)center dot(H2O)(0-14) clusters
期刊论文
OAI收割
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2019, 卷号: 119, 期号: 7, 页码: 21
作者:
Xu, Zhen-Zhen
;
Fan, Hong-Jun
  |  
收藏
  |  
浏览/下载:39/0
  |  
提交时间:2019/06/20
binding enthalpy
conformational search
hydrogen bond
proton transfer
ternary cluster
A theoretical investigation on the structures of (nh3)center dot(h2so4)center dot(h2o)(0-14) clusters
期刊论文
iSwitch采集
International journal of quantum chemistry, 2019, 卷号: 119, 期号: 7, 页码: 21
作者:
Xu, Zhen-Zhen
;
Fan, Hong-Jun
收藏
  |  
浏览/下载:73/0
  |  
提交时间:2019/05/08
Binding enthalpy
Conformational search
Hydrogen bond
Proton transfer
Ternary cluster
On the solvation of hydronium by carbon dioxide: Structural and infrared spectroscopic study of (H3O+)(CO2)(n)
期刊论文
OAI收割
CHEMICAL PHYSICS, 2018, 卷号: 501, 页码: 1-7
作者:
Yang, Jianpeng
;
Kong, Xiangtao
;
Jiang, Ling
  |  
收藏
  |  
浏览/下载:11/0
  |  
提交时间:2019/06/20
Hydronium
Carbon Dioxide
Solvation
Infrared Photodissociation Spectroscopy
Quantum Chemical Calculation
Structural and Infrared Spectroscopic Study on Solvation of Acetylene by Protonated Water Molecules
期刊论文
OAI收割
CHINESE JOURNAL OF CHEMICAL PHYSICS, 2016, 卷号: 29, 期号: 1, 页码: 31-37
作者:
Kong, Xiang-tao
;
Lei, Xin
;
Yuan, Qin-qin
;
Zhang, Bing-bing
;
Zhao, Zhi
  |  
收藏
  |  
浏览/下载:13/0
  |  
提交时间:2019/06/20
Acetylene
Water
Solvation
Infrared Photodissociation Spectroscopy
Quantum Chemical Calculation
First-principle investigation of the structure and vibrational spectra of the local structures in LiF-BeF2 Molten Salts
期刊论文
OAI收割
JOURNAL OF MOLECULAR LIQUIDS, 2016, 卷号: 213, 期号: -, 页码: 17—22
作者:
Dai, JX
;
Han, H
;
Li, QN
;
Huai, P
收藏
  |  
浏览/下载:27/0
  |  
提交时间:2016/09/12
INITIO MOLECULAR-DYNAMICS
SPACE GAUSSIAN PSEUDOPOTENTIALS
INFRARED-SPECTRUM
LIQUID WATER
PROTONATED PEPTIDES
RAMAN-SPECTRA
SPECTROSCOPY
SIMULATIONS
DENSITY
MIXTURES
Reversible formation of regular pentagonal dodecahedral (H2O)(20) in a 2D metal-organic framework
期刊论文
OAI收割
Crystengcomm, 2010, 卷号: 12, 期号: 5, 页码: 1377-1381
R. L. Sang and L. Xu
收藏
  |  
浏览/下载:35/0
  |  
提交时间:2012/11/02
protonated water clusters
supramolecular complex
clathrate hydrate
hydrogen storage
cyclic (h2o)(4)
x-ray
molecular-crystals
methane
hydrate
ab-initio
form
Synthesis, Structure and Chromic Properties of 4,4 '-Bipyridine Polyoxomolybdate
期刊论文
OAI收割
acta physico-chimica sinica, 2010, 卷号: 26, 期号: 5, 页码: 1264-1270
Sun DH
;
Zhang JL
;
Ren HJ
;
Cui ZF
;
Sun DX
收藏
  |  
浏览/下载:20/0
  |  
提交时间:2012/06/06
HYDROTHERMAL SYNTHESES
CRYSTAL-STRUCTURES
ORGANIC SUBSTRATE
HYBRID MATERIALS
POLYOXOMETALATE
COMPLEXES
CLUSTERS
CHAINS
FILMS
Unprecedented 2-d hydrated proton encapsulated in supramolecular framework built of [mo3o4(c2o4)(h2o)(3)](2-)
期刊论文
iSwitch采集
Inorganic chemistry communications, 2008, 卷号: 11, 期号: 4, 页码: 353-357
作者:
Zhao, Jun
;
Xu, Li
收藏
  |  
浏览/下载:7/0
  |  
提交时间:2019/05/10
Hydrated proton
Water sheet
H-bonds
A novel 3D network structure constructed from centrosymmetric sodium-phosphomolybdate bonding by sodium and zinc atoms
期刊论文
OAI收割
Inorganic Chemistry Communications, 2007, 卷号: 10, 期号: 11, 页码: 1285-1288
X. Q. Chen
;
S. Lin
;
L. J. Chen
;
X. H. Chen
;
C. L. Liu
;
J. B. Chen
;
L. Y. Yang
收藏
  |  
浏览/下载:19/0
  |  
提交时间:2013/04/01
polyoxometalates
hydrothermal synthesis
3D framework
photocatalysis
organic hybrid materials
hydrothermal synthesis
molybdenum(v)
phosphate
photocatalytic degradation
coordination cations
vanadium
phosphate
open-framework
built-up
clusters
molybdophosphate