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theoretical characterization
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ThAu2-, ThAu2O- and ThAuOH- anions: Photoelectron Spectroscopic and Theoretical Characterization
The Journal of Chemical Physics
◽
10.1063/5.0079795
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2022
◽
Author(s):
Zhaoguo Zhu
◽
Mary Marshall
◽
Kit H. Bowen
◽
Kirk A. Peterson
Keyword(s):
Theoretical Characterization
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Complete experimental and theoretical characterization of nonlinear concentration gradient generator microfluidic device for analytical purposes
Microchimica Acta
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10.1007/s00604-021-05110-7
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2021
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Vol 189
(1)
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Author(s):
Paulo Henrique Maciel Buzzetti
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Maiara Mitiko Taniguchi
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Nayara de Souza Mendes
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Renata Corrêa Vicentino
◽
Jean Halison de Oliveira
◽
...
Keyword(s):
Microfluidic Device
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Concentration Gradient
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Gradient Generator
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Theoretical Characterization
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Newly Synthesized Three-Dimensional Boron-Rich Chalcogenides B12X (X = S and Se): Theoretical Characterization of the Physical Properties for Optoelectronic and Mechanical Applications
ACS Omega
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10.1021/acsomega.1c05172
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2021
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Author(s):
Md. Mukter Hossain
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Md. Ashraf Ali
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Md. Mohi Uddin
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Saleh Hasan Naqib
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A. K. M. Azharul Islam
Keyword(s):
Physical Properties
◽
Three Dimensional
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Theoretical Characterization
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Synthesis, growth, experimental, and theoretical characterization of 6-amino-1H-pyrimidine-2,4-dione dimethylacetamide single crystal
Chinese Journal of Physics
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10.1016/j.cjph.2021.10.037
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2021
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Author(s):
S. Mugeshini
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R. Santhakumari
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N. Rajeshwari
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G. Amudha
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D. Chandrika
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...
Keyword(s):
Single Crystal
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Theoretical Characterization
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of a new triazoloquinoxaline derivative by azide-alkyne click chemistry: Experimental and Theoretical Characterization
Journal of Molecular Structure
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10.1016/j.molstruc.2021.132132
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2021
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pp. 132132
Author(s):
Mohcine Missioui
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Hassane Lgaz
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Walid Guerrab
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Han-seung Lee
◽
Ismail Warad
◽
...
Keyword(s):
Click Chemistry
◽
Theoretical Characterization
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Theoretical characterization and computational discovery of ultra-wide-band-gap semiconductors with predictive atomistic calculations
Journal of Materials Research
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10.1557/s43578-021-00437-6
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2021
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Author(s):
Emmanouil Kioupakis
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Sieun Chae
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Kyle Bushick
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Nick Pant
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Xiao Zhang
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...
Keyword(s):
Band Gap
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Wide Band
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Ultra Wide Band
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Wide Band Gap
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Atomistic Calculations
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Wide Band Gap Semiconductors
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Theoretical Characterization
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Computational Discovery
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Pseudofields in Type I and Type II Weyl Semimetals: A Theoretical Characterization of Fermi Arcs
10.26226/morressier.616e5c2362ba8657678b122f
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2021
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Author(s):
Cesar Antonio Doñez Miranda
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Jose Eduardo Barrios Vargas
Keyword(s):
Type I
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Type Ii
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Fermi Arcs
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Weyl Semimetals
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Theoretical Characterization
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Intramolecular N–H…F Hydrogen Bonding Interaction in a Series of 4‐Anilino‐5‐Fluoroquinazolines: Experimental and Theoretical Characterization of Electronic and Conformational Effects
Chemistry - A European Journal
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10.1002/chem.202103135
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2021
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Author(s):
K. N. Houk
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Lorenz M. Urner
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Ga Young Lee
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Saeed I. Khan
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Michael Ernest Jung
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...
Keyword(s):
Hydrogen Bonding
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Hydrogen Bonding Interaction
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Conformational Effects
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Bonding Interaction
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Theoretical Characterization
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Four and six-coordinated cobalt complexes based on thiosemicarbazone. Formation, experimental and theoretical characterization
Journal of Molecular Structure
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10.1016/j.molstruc.2021.131783
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2021
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pp. 131783
Author(s):
Büşra Kaya
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Tuncay Karakurt
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Onur Şahin
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Bahri ÜLKÜSEVEN
Keyword(s):
Cobalt Complexes
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Theoretical Characterization
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Synthesis, electrochemical and theoretical characterization of schiff base as an anticorrosive molecule for mild steel in 0.5 M H2SO4 medium
Chemical Papers
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10.1007/s11696-021-01819-0
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2021
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Author(s):
Anita Kumari
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Raj Kishore Sharma
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Gurmeet Kaur
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Suman Lata
◽
Gurmeet Singh
Keyword(s):
Schiff Base
◽
Mild Steel
◽
Theoretical Characterization
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