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مقال دورية
6
Excellent Static and dynamic hyperpolarizabilities of TM@C6O6Li6 (TM = Sc, Ti, V, Cr and Mn) complexes to prove their NLO applications
Kosar, Naveen
Elsevier GmbH
2023
Excellent Static and dynamic hyperpolarizabilities of TM@C6O6Li6 (TM = Sc, Ti, V, Cr and Mn) complexes to prove their NLO applications
-
مقال دورية
5
Adsorption of Industrial Gases (CH4, CO2, and CO) on Olympicene : A DFT and CCSD(T) Investigation
Sohail, Uroosa
American Chemical Society
2022
Adsorption of Industrial Gases (CH4, CO2, and CO) on Olympicene : A DFT and CCSD(T) Investigation
-
مقال دورية
2
Shedding light on static and dynamic hyperpolarizabilities of thia[7&8]circulenes, toward their NLO applications
Kosar, Naveen
University of Bahrain
2022
Shedding light on static and dynamic hyperpolarizabilities of thia[7&8]circulenes, toward their NLO applications
-
مقال دورية
3
Designing of dimethylfluorene-based hole transport materials for high-performance organic/perovskite solar cells
Zahid, Waqar Ali
University of Bahrain
2023
Designing of dimethylfluorene-based hole transport materials for high-performance organic/perovskite solar cells
-
مقال دورية
1
Chemical sensing ability of aminated graphdiyne (GDY-NH2) toward highly toxic organic volatile pollutants
Allangawi, Abdulrahman
Elsevier B.V.
Chemical sensing ability of aminated graphdiyne (GDY-NH2) toward highly toxic organic volatile pollutants
-
مقال دورية
4
Toward High‑Performance Quinoxaline Based Non‑fullerene Small Molecule Acceptors for Organic Solar Cells
Ayub, Amna
University of Bahrain
2023
Toward High‑Performance Quinoxaline Based Non‑fullerene Small Molecule Acceptors for Organic Solar Cells
-
مقال دورية
1
Alkaline earthides based on 15-crown-5 ether with remarkable NLO response
Ahsan, Annum
Springer-Verlag GmbH
2022
Alkaline earthides based on 15-crown-5 ether with remarkable NLO response
-
مقال دورية
1
Alkaline earth metals (Be, Mg, Ca) doped hexamine complexant with enhanced electronic and nonlinear optical properties
Gul, Shehla
University of Bahrain
2022
Alkaline earth metals (Be, Mg, Ca) doped hexamine complexant with enhanced electronic and nonlinear optical properties
-
مقال دورية
2
High drug carrying efficiency of boron-doped Triazine based covalent organic framework toward anti-cancer tegafur; a theoretical perspective
Allangawi, Abdulrahman
Elsevier
2023
High drug carrying efficiency of boron-doped Triazine based covalent organic framework toward anti-cancer tegafur; a theoretical perspective
-
مقال دورية
6
Diamondoid as potential nonlinear optical material by superalkali doping: A first principles study
Bano, Rehana
Elsevier, ScienceDirect
2023
Diamondoid as potential nonlinear optical material by superalkali doping: A first principles study
-
مقال دورية
1
Assessment of alkali and alkaline earth metals doped cubanes as high-performance nonlinear optical materials by first-principles study
Naeem, Javaria
Elsevier B.V.
2022
Assessment of alkali and alkaline earth metals doped cubanes as high-performance nonlinear optical materials by first-principles study
-
مقال دورية
1
Designing neodymium‑doped hexamine complexant as novel IR NLO material with extremely large non‑linear optical behavior
Hameed, Shanza
University of Bahrain
2022
Designing neodymium‑doped hexamine complexant as novel IR NLO material with extremely large non‑linear optical behavior
مقال دورية
5
Reversible H2 Storage Capacity of Ni Functionalized Carbyne (C10) Complex
Kosar, Naveen
Springer
2023
Reversible H2 Storage Capacity of Ni Functionalized Carbyne (C10) Complex
-
مقال دورية
5
Ab initio study for superior sensitivity of graphyne nanofake towards nitrogen halides over ammonia
Sajid, Hasnain
University of Bahrain
2022
Ab initio study for superior sensitivity of graphyne nanofake towards nitrogen halides over ammonia
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الأنجليزية
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مقال دورية
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الموضوع
Density functional theory -- Essays
(3)
Nonlinear optical -- Essays
(2)
Adamantane -- Essays
(1)
Adsorption -- Essays
(1)
Alkali metals -- Essays
(1)
Alkaline earth metals -- Essays
(1)
Aminated graphdiyne -- Essays
(1)
Ammonia -- Essays
(1)
C10 carbyne -- Essays
(1)
CCSD(T) -- Essays
(1)
Circulene -- Essays
(1)
DFT-- Essays
(1)
DFT -- Essays
(1)
DFT calculations -- Essays
(1)
Dimethylfluorene -- Essays
(1)
Diphenylamine -- Essays
(1)
Doping -- Essays
(1)
Drug carrier -- Essays
(1)
Electron density -- Essays
(1)
First-principles study -- Essays
(1)
Frequency-dependent hyperpolarizability -- Essays
(1)
Graphyne nanofake -- Essays
(1)
Hole-transporting materials -- Essays
(1)
Hole mobility -- Essays
(1)
Hydrogen storage -- Essays
(1)
Hyperpolarizability -- Essays
(1)
Inorganic carbon compounds -- Essays
(1)
Interaction energies -- Essays
(1)
Interaction energy -- Essays
(1)
IR -- Essays
(1)
Molecular dynamics -- Essays
(1)
Neodymium -- Essays
(1)
Nitrogen halides -- Essays
(1)
Non-liner optical -- Essays
(1)
Nonlinear optical response -- Essays
(1)
Nonlinear optics -- Essays
(1)
Nonlinear optics -- Essays
(1)
Organic pollutants -- Essays
(1)
Organometallic -- Essays
(1)
Oxides -- Essays
(1)
Perovskite solar cells -- Essays
(1)
QTAIM -- Essays
(1)
Recovery time -- Essays
(1)
refractive index -- Essays
(1)
Refractive indices -- Essays
(1)
Static and dynamic hyperpolarizability -- Essays
(1)
Superalkali clusters -- Essays
(1)
Therapeutic potential -- Essays
(1)
Triazine-COF -- Essays
(1)
المؤلف
Kosar, Naveen
(3)
Ahsan, Annum
(1)
Allangawi, Abdulrahman
(1)
Allangawi, Abdulrahman
(1)
Ayub, Amna
(1)
Bano, Rehana
(1)
Gul, Shehla
(1)
Hameed, Shanza
(1)
Naeem, Javaria
(1)
Sajid, Hasnain
(1)
Sohail, Uroosa
(1)
Zahid, Waqar Ali
(1)
الناشر
University of Bahrain
(6)
Elsevier B.V.
(2)
American Chemical Society
(1)
Elsevier
(1)
Elsevier, ScienceDirect
(1)
Elsevier GmbH
(1)
Springer
(1)
Springer-Verlag GmbH
(1)