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期刊论文 [43]
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Revealing the Reaction Mechanism of Sodium Selenide Confined within a Single-Walled Carbon Nanotube: Implications for Na–Se Batteries
期刊论文
ACS Applied Materials & Interfaces, 2019, 卷号: Vol.11 No.5, 页码: 4995-5002
作者:
Wang, L
;
Zhang, XM
;
Deng, L
;
Tang, JF
;
Deng, HQ
收藏
  |  
浏览/下载:29/0
  |  
提交时间:2019/12/13
Na−Se battery
nanoconfinement
reaction mechanism
conductivity
polaron
ab initio molecular dynamics
density functional theory computation
Revealing the Reaction Mechanism of Sodium Selenide Confined within a Single-Walled Carbon Nanotube: Implications for Na–Se Batteries
期刊论文
ACS Applied Materials & Interfaces, 2019, 卷号: Vol.11 No.5, 页码: 4995-5002
作者:
Liang Wang
;
Xingming Zhang
;
Lei Deng
;
Jianfeng Tang
;
Huiqiu Deng
收藏
  |  
浏览/下载:6/0
  |  
提交时间:2019/12/13
ab
initio
molecular
dynamics
conductivity
density
functional
theory
computation
nanoconfinement
Na−Se
battery
polaron
reaction
mechanism
Revealing the Reaction Mechanism of Sodium Selenide Confined within a Single-Walled Carbon Nanotube: Implications for Na-Se Batteries
期刊论文
ACS APPLIED MATERIALS & INTERFACES, 2019, 卷号: Vol.11 No.5, 页码: 4995-5002
作者:
Wang, L
;
Zhang, XM
;
Deng, L
;
Tang, JF
;
Deng, HQ
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2019/12/17
Na-Se battery
nanoconfinement
reaction mechanism
conductivity
polaron
ab initio molecular dynamics
density functional theory computation
Revealing the Reaction Mechanism of Sodium Selenide Confined within a Single-Walled Carbon Nanotube: Implications for Na-Se Batteries
期刊论文
ACS Applied Materials and Interfaces, 2019, 卷号: 11, 期号: 5, 页码: 4995-5002
作者:
Wang, Liang
;
Zhang, Xingming
;
Deng, Lei
;
Tang, Jianfeng
;
Deng, Huiqiu*
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2019/12/23
Na-Se battery
ab initio molecular dynamics
conductivity
density functional theory computation
nanoconfinement
polaron
reaction mechanism
Programmable DNA Nanoindicator-Based Platform for Large-Scale Square Root Logic Biocomputing
期刊论文
Small, 2019, 卷号: 15, 期号: 49, 页码: 9
作者:
C.Y.Zhou
;
H.M.Geng
;
P.F.Wang
;
C.L.Guo
收藏
  |  
浏览/下载:2/0
  |  
提交时间:2020/08/24
DNA hybridization,DNA switching,square root logic circuits,toehold,mediated reaction,enzyme-free,molecular logic,label-free,computation,operations,gates,circuit,system,half,Chemistry,Science & Technology - Other Topics,Materials Science,Physics
Screening of Novel Histone Deacetylase 7 Inhibitors through Molecular Docking Followed by a Combination of Molecular Dynamics Simulations and Ligand-Based Approach.
期刊论文
Journal of biomolecular structure & dynamics, 2018, 页码: 1-30
作者:
Yuan Yuan
;
Hu Zongyue
;
Bao Minyue
;
Sun Rong
;
Long Xin
收藏
  |  
浏览/下载:10/0
  |  
提交时间:2019/02/28
CoMSIA
histone
deacetylase
7
molecular
docking
molecular
dynamics
simulations
similarity
computation
Computation in Chemistry: A Summary of the Development and Models of DNA Computing
期刊论文
PROGRESS IN CHEMISTRY, 2017, 卷号: 29, 期号: 11, 页码: 1297-1315
作者:
Yin, XY
;
Li, F
;
Bo, XC
;
Luo, ZG
;
Zuo, XL
收藏
  |  
浏览/下载:25/0
  |  
提交时间:2018/08/30
Molecular Computation
Strand Displacement
Logic-circuits
Hairpin Formation
Construction
Gates
Fluorescence
Complexes
Automaton
Ligation
Ultrafast two-dimensional infrared spectroscopy for molecular structures and dynamics with expanding wavelength range and increasing sensitivities: from experimental and computational perspectives
期刊论文
INTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY, 2017, 卷号: 36, 期号: 3, 页码: 377-431
作者:
Wang, Jianping
收藏
  |  
浏览/下载:53/0
  |  
提交时间:2018/04/11
Broadband Two-dimensional Infrared Spectroscopy
Anharmonic Potential
Anharmonicity
All-mode Vibrational Analysis
Correlated Vibrations
Molecular Structures And Dynamics
Isotopic Labelling
Surface-enhanced Infrared
Ab Initio Computation
Molecular Dynamics Simulations
Mid-ir Continuum
Overtone 2d Ir
3d Ir
Molecular computation based on tile assembly model: modular-multiplication and modular-square over finite field GF(2(n))
会议论文
18th IEEE International Conference on High Performance Computing and Communications (HPCC) / 14th IEEE International Conference on Smart City (Smart City) / 2nd IEEE International Conference on Data Science and Systems (DSS), Sydney, AUSTRALIA, 2016-01-01
作者:
Li, Yongnan
;
Xiao, Limin
收藏
  |  
浏览/下载:5/0
  |  
提交时间:2019/12/30
Modular-multiplication
Modular-square
Assembly rules
Molecular computation
DNA-based visual majority logic gate with one-vote veto function
期刊论文
chemical science, 2015, 卷号: 6, 期号: 3, 页码: 1973-1978
作者:
Fan,Daoqing
;
Wang,Kun
;
Zhu,Jinbo
;
Xia,Yong
;
Han,Yanchao
收藏
  |  
浏览/下载:55/0
  |  
提交时间:2016/05/03
STRAND DISPLACEMENT
CELLULAR-AUTOMATA
MOLECULAR LOGIC
DNAZYME
CIRCUIT
COMPUTATION
SYSTEM
INPUTS
SWITCH
ADDER
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