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First Principle Study on Effects of Al and Fe Doping on Properties of Cr20Ni80 Electrothermal Alloy
期刊论文
Cailiao Daobao/Materials Reports, 2022, 卷号: 36, 期号: 11
作者:
Li, Yamin
;
Zhang, Yaoyao
;
Zhou, Shengrui
;
Liu, Hongjun
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浏览/下载：15/0
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提交时间：2022/07/20
Aluminum
Binary alloys
Binding energy
Calculations
Chromium alloys
Iron alloys
Al-doping
Cr20ni80 electrothermal alloy
Elastic properties
Fe doping
First principles
First-principle study
Formation heat
Property
Super cell
Supercell model
Vacancy defects on optoelectronic properties of double perovskite Cs2AgBiBr6
期刊论文
Materials Science in Semiconductor Processing, 2021, 卷号: 123
作者:
Chen, Hong
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浏览/下载：2/0
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提交时间：2021/03/02
Binding energy
Bismuth compounds
Cesium compounds
Crystal atomic structure
Defects
Density functional theory
Electronic structure
Energy gap
Excitons
Light absorption
Perovskite
Red Shift
Silver compounds
Absorption capability
Double perovskites
Exciton-binding energy
Low energy regions
Optoelectronic properties
Slight deformations
Supercell model
Vacancy effects
Capturing transient antibody conformations with DNA origami epitopes
期刊论文
NATURE COMMUNICATIONS, 2020, 卷号: 11, 期号: 1, 页码: -
作者:
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浏览/下载：18/0
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提交时间：2021/09/06
ATOMIC-FORCE MICROSCOPY
HIV-ANTIBODIES
INDUCED FIT
IGG
NEUTRALIZATION
COMPLEXES
MOLECULES
MECHANISM
BINDING
MODEL
Dirac cones in a snub trihexagonal tiling lattice with reflective symmetry breaking
期刊论文
JOURNAL OF PHYSICS-CONDENSED MATTER, 2019, 卷号: 31, 期号: 15
作者:
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浏览/下载：10/0
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提交时间：2019/12/11
2D dirac materials
reflective symmetry
snub trihexagonal tiling
lattice
tight-binding model
first-principles calculations
Development of a coupled model of quantitative ion character-activity relationships-biotic ligand model (QICARs-BLM) for predicting toxicity for data poor metals
期刊论文
JOURNAL OF HAZARDOUS MATERIALS, 2019, 卷号: 373, 页码: 620-629
作者:
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浏览/下载：4/0
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提交时间：2019/12/30
Biotic ligand model (BLM)
Quantitative ion character-activity relationships (QICARs)
Metals
Conditional binding constants (K)
Median effective concentration (EC50)
Effect of lignin degradation product sinapyl alcohol on laccase catalysis during lignin degradation
期刊论文
INDUSTRIAL CROPS AND PRODUCTS, 2019, 卷号: 139, 页码: -
作者:
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浏览/下载：10/0
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提交时间：2020/10/16
BOVINE SERUM-ALBUMIN
MOLECULAR DOCKING
BINDING INTERACTION
MECHANISM
PROTEIN
FUNGAL
MODEL
MEDIATORS
BACTERIAL
A binding model study on TNP fluorescent sensor 4,40-(9,9 dimethylfluorene-2,7-diy1)dibenzoic acid
期刊论文
JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY, 2018, 卷号: 367, 页码: 282-289
作者:
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浏览/下载：120/0
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提交时间：2019/06/20
Binding model
Time-dependent density functional theory
Weak interactions
TNP sensing
Photoinduced electron transfer
Binding energy
A binding model study on tnp fluorescent sensor 4,40-(9,9 dimethylfluorene-2,7-diy1)dibenzoic acid
期刊论文
Journal of photochemistry and photobiology a-chemistry, 2018, 卷号: 367, 页码: 282-289
作者:
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浏览/下载：139/0
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提交时间：2019/05/08
Binding model
Time-dependent density functional theory
Weak interactions
Tnp sensing
Photoinduced electron transfer
Binding energy
An empirical law for the elastic moduli of component-segregated W/Cu compounds
期刊论文
JOURNAL OF ALLOYS AND COMPOUNDS, 2018, 卷号: 766, 页码: 349-354
作者:
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浏览/下载：16/0
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提交时间：2019/12/20
W/Cu compounds
Tight-binding potential model
Atomic structure
Empirical law
Mechanical property
Massive neutron stars and Lambda-hypernuclei in relativistic mean field models
期刊论文
CHINESE PHYSICS C, 2018, 卷号: 42, 期号: 2, 页码: 25101
作者:
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浏览/下载：139/0
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提交时间：2018/12/27
MESON COUPLING MODEL
P-SHELL HYPERNUCLEI
EQUATION-OF-STATE
BINDING-ENERGIES
XI-HYPERNUCLEI
GROUND-STATE
NUCLEI
MATTER
MASSES
SIGMA
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