Author

Heider A. Abdulhussein

Observed names: H. A. Hussein, Heider A Hussein, Heider A. Hussein

Institutions: University of Warith Al-Anbiyaa, University of Kufa

Observed institutions: The Edgbaston Hospital, University of Warith Al-Anbiyaa, University of Kufa, University of Birmingham

ORCID: 0000-0003-0797-5962

Observed ORCID: 0000-0003-0797-5962

OpenAlex ID: A5071913888

DFT Global Optimization of Gas-Phase Subnanometer Ru–Pt Clusters

2016 · Ilker Demiroglu, Kezi Yao, et al. · The Journal of Physical Chemistry C · 51

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DFT global optimisation of gas-phase and MgO-supported sub-nanometre AuPd clusters

2016 · Heider A. Hussein, Jack B. A. Davis, et al. · Physical Chemistry Chemical Physics · 45

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A comprehensive analysis of the structural, phonon, electronic, mechanical, optical, and thermophysical properties of cubic Ca3SbX3 (X = Cl, Br): DFT - GGA and mBJ studies

2024 · Heider A. Abdulhussein, Md Adil Hossain, et al. · Materials Science in Semiconductor Processing · 43

Investigation of the physical properties and pressure-induced band gap tuning of Sr3ZBr3 (Z=As, Sb) for optoelectronic and thermoelectric applications: A DFT - GGA and mBJ studies

2024 · Md. Adil Hossain, Asif Hosen, et al. · Results in Engineering · 43

DFT study of the structure, chemical ordering and molecular adsorption of Pd–Ir nanoalloys

2017 · Tian-E Fan, Ilker Demiroglu, et al. · Physical Chemistry Chemical Physics · 40

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Study on pressure-induced band gap modulation and physical properties of direct band gap Ca3NX3 (X = Cl, Br) for optoelectronic and thermoelectric applications

2024 · Maruf Al Yeamin, Asif Hosen, et al. · Surfaces and Interfaces · 34

DFT-Based Global Optimization of Sub-nanometer Ni–Pd Clusters

2019 · Alejandra Granja-DelRío, Heider A. Abdulhussein, et al. · The Journal of Physical Chemistry C · 33

A comprehensive analysis of structural, electronic, optical, mechanical, thermodynamic, and thermoelectric properties of direct band gap Sr3BF3 (B = As, Sb) photovoltaic compounds: DFT-GGA and mBJ approach

2024 · Muneef Hasan, Adil Hossain, et al. · Inorganic Chemistry Communications · 31

Altering CO binding on gold cluster cations by Pd-doping

2019 · Heider A. Abdulhussein, Piero Ferrari, et al. · Nanoscale · 29

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Effect of palladium doping on the stability and fragmentation patterns of cationic gold clusters

2018 · P. Ferrari, H. A. Hussein, et al. · Physical Review A · 29

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First-principles insights into NaScQH6 (Q = Fe, Ru, Os): Promising high-density hydrogen storage materials

2025 · Asif Hosen, Afsaneh Sadeghi, et al. · International Journal of Hydrogen Energy · 25

Insights into the pressure-dependent physical properties of cubic Ca3MF3 (M = As and Sb): First-principles calculations

2024 · Md. Adil Hossain, Ali A. Sabi, et al. · Heliyon · 24

Ga-doped AlN monolayer nano-sheets as promising materials for environmental sensing applications

2023 · Tamadhur Alaa Hussein, Warood Kream Alaarage, et al. · Computational and Theoretical Chemistry · 24

Computational analysis of CdS monolayer nanosheets for gas-sensing applications

2023 · Warood Kream Alaarage, Abbas H. Abo Nasria, et al. · The European Physical Journal B · 23

A systematic computational study on Na-based complex hydrides NaMXH6 (M = Sr, Ba; X = Co, Rh, Ir): A promising class of hydrogen storage materials

2025 · Khidhir Alhameedi, Asif Hosen, et al. · Chinese Journal of Physics · 20

Application of a parallel genetic algorithm to the global optimization of medium-sized Au–Pd sub-nanometre clusters

2018 · Heider A. Hussein, Ilker Demiroglu, et al. · The European Physical Journal B · 20

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Anti-breast cancer potential of new indole derivatives: Synthesis, in-silico study, and cytotoxicity evaluation on MCF-7 cells

2024 · Rehab G. Abood, Heider A. Abdulhussein, et al. · Journal of Molecular Structure · 19

Synthesis, molecular docking, and anti-breast cancer study of 1-H-indol-3-Carbohydrazide and their derivatives

2024 · Zainab H. Mahdi, Tahseen A. Alsalim, et al. · Results in Chemistry · 17

Global minima and structural properties of Au Fe nanoalloys from a Mexican Enhanced Genetic Algorithm-based Density Functional Theory

2021 · Manal Abed Mohammed, Heider A. Abdulhussein, et al. · Chemical Physics Letters · 16

Physico-Chemical Insights into Gas-Phase and Oxide-Supported Sub-Nanometre AuCu Clusters

2019 · Heider A. Hussein, Mansi Gao, et al. · Zeitschrift für Physikalische Chemie · 16

Comprehensive first-principles analysis on rare earth complex hydrides LiABH6 (A = Sc, Y; B = Fe, Ru, Os): A promising class of hydrogen storage materials

2025 · Asif Hosen, Ebrahim Nemati-Kande, et al. · Journal of Rare Earths · 15

The DFT-genetic algorithm approach for global optimization of subnanometer bimetallic clusters

2018 · Heider A. Hussein, Roy L. Johnston · Frontiers of nanoscience · 15

Computational assessment of novel KBaMH6 (M = Co, Rh, Ir) complex hydrides for hydrogen storage applications: A DFT and AIMD insight

2025 · Hameed T. Abdulla, Nawzad A. Abdulkareem, et al. · International Journal of Hydrogen Energy · 14

Computational insights into the physico-chemical properties of pure and single-atom copper–indium sub-nanometre clusters: a DFT-genetic algorithm approach

2025 · Norah O. Alotaibi, Heider A. Abdulhussein, et al. · RSC Advances · 14

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Indium‐Catalyzed Direct Amidation Reaction of Carboxylic Acids and In Silico Study for Screening the Activity of Potential Therapeutics of the Synthesized Products

2024 · Mohanad A. Hussein, Mohammed Hadi Ali Al‐Jumaili, et al. · ChemistrySelect · 14

Works count: 38

Citation count: 732

H-index: 17

I10-index: 30