Combined DFT and Monte Carlo simulation studies of potential corrosion inhibition properties of heterocyclic derivatives with an extended π-System
Hussein Azeez, Yousif, Obaid Kareem, Rebaz, Omer Ahmed, Lana, Anwar Omer, Rebaz, Ahmed Othman, Khdir, Safin, Damir A.
Published in Computational and theoretical chemistry (01.10.2024)
Published in Computational and theoretical chemistry (01.10.2024)
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Journal Article
The inhibitor activity of some azo compound derivatives using density functional theory and molecular dynamics simulations
Mustafa Mamad, Dyari, Hussein Azeez, Yousif, Khalid Kaka, Askander, Mahmood Ahmed, Karzan, Anwar Omer, Rebaz, Omer Ahmed, Lana
Published in Computational and theoretical chemistry (01.07.2024)
Published in Computational and theoretical chemistry (01.07.2024)
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Journal Article
Spectroscopic characteristics, stability, reactivity, and corrosion inhibition of AHPE-dop compounds incorporating (B, Fe, Ga, Ti): A DFT investigation
Azeez, Yousif Hussein, Kareem, Rebaz Obaid, Qader, Aryan Fathulla, Omer, Rebaz Anwar, Ahmed, Lana Omer
Published in Next materials (01.04.2024)
Published in Next materials (01.04.2024)
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Journal Article
Optical conductivity enhancement and thermal reduction of BN-codoped MgO nanosheet: Significant effects of B-N atomic interaction
Nzar Rauf Abdullah, Botan, Jawdat Abdullah, Yousif Hussein Azeez, Chi-Shung Tang, Gudmundsson, Vidar
Published in arXiv.org (15.07.2023)
Published in arXiv.org (15.07.2023)
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Paper
Journal Article
Role of planar buckling on the electronic, thermal, and optical properties of Germagraphene nanosheets
Nzar Rauf Abdullah, Yousif Hussein Azeez, Botan, Jawdat Abdullah, Hunar Omar Rashid, Manolescu, Andrei, Gudmundsson, Vidar
Published in arXiv.org (09.10.2022)
Published in arXiv.org (09.10.2022)
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Paper
Journal Article
Role of planar buckling on the electronic, thermal, and optical properties of Germagraphene nanosheets
Abdullah, Nzar Rauf, Azeez, Yousif Hussein, Abdullah, Botan Jawdat, Rashid, Hunar Omar, Manolescu, Andrei, Gudmundsson, Vidar
Published in Materials science in semiconductor processing (01.01.2023)
Published in Materials science in semiconductor processing (01.01.2023)
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Journal Article
Optical conductivity enhancement and thermal reduction of BN-codoped MgO nanosheet: Significant effects of B-N atomic interaction
Abdullah, Nzar Rauf, Abdullah, Botan Jawdat, Azeez, Yousif Hussein, Tang, Chi-Shung, Gudmundsson, Vidar
Published in Solid state communications (15.09.2023)
Published in Solid state communications (15.09.2023)
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Journal Article
High thermal insulation and excellent thermal stability of ScCl 3 monolayer: DFT study of electronic, phonon, magnetic, thermal, and optical properties
Azeez, Yousif Hussein, Pirot, Bashdar Rahman, Abdullah, Nzar Rauf, Gudmundsson, Vidar
Published in Materials science in semiconductor processing (01.01.2025)
Published in Materials science in semiconductor processing (01.01.2025)
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Journal Article
High thermal insulation and excellent thermal stability of ScCl3 monolayer: DFT study of electronic, phonon, magnetic, thermal, and optical properties
Azeez, Yousif Hussein, Pirot, Bashdar Rahman, Abdullah, Nzar Rauf, Gudmundsson, Vidar
Published in Materials science in semiconductor processing (01.01.2025)
Published in Materials science in semiconductor processing (01.01.2025)
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Journal Article
Investigation of corrosion inhibition and adsorption properties of quinoxaline derivatives on metal surfaces through DFT and Monte Carlo simulations
Azeez, Yousif Hussein, Mamand, Dyari Mustafa, Omer, Rebaz A., Awla, Awat Hamad, Omar, Karzan A.
Published in Corrosion reviews (19.07.2024)
Published in Corrosion reviews (19.07.2024)
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Journal Article
Exploring electronic, optical, and phononic properties of MgX (X=C, N, and O) monolayers using first principle calculations
Abdullah, Nzar Rauf, Abdullah, Botan Jawdat, Azeez, Yousif Hussein, Gudmundsson, Vidar
Year of Publication 15.07.2023
Year of Publication 15.07.2023
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Journal Article