The influence of Holmium substitution on the magnetic and mechanical properties of Nd2Fe14B: a first principle study by Baloyi Mphamela Enos, Ngoepe Phuti, Chauke Hasani

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Development and energy analysis of a solar-assisted air conditioning system for energy saving by Brice Sandong Omgba, Frederic Lontsi, Max Keller Ndame, Sosso Mayi Thierry Olivier, Innocent Ndoh Mbue

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Computational studies on magnesium spinel’s [MgY2S4 and MgY2Se4] by Tibane Khumbulani, Ngoepe Phuti, Masedi Cliffton

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Stability of NaO2 and LiO2 discharge products in metal-air batteries: density functional theory study by Ramogayana Brian, Maenetja Khomotso P., Ngoepe Phuti E.

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Effect of Gadolinium rare-earth element on Nd2Fe14B permanent magnet by Baloyi Mphamela Enos, Ngoepe Phuti, Chauke Hasani

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Fostering research and innovation in materials manufacturing for Industry 5.0: The key role of domain intertwining between materials characterization, modelling and data science by Costas Charitidis, Marco Sebastiani, Gerhard Goldbeck

“…On this basis, fine-tuning of adaptive materials modelling/characterization protocols can be achieved and facilitate computational and experimental efforts. …”
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Exploring Synergistic Effect on the Stability of Ni-, Pd-, Ir-Doped Ti_N (N = 1–15) Nanoparticles by Tshegofatso Phaahla, Phuti Ngoepe, Hasani Chauke

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Highlighting the effect of the lower operating limit of the condenser on ORC working fluids selection by Julbin Paul Njock, Max Ndame Ngangué, Olivier Thierry Sosso, Robert Nzengwa

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The behaviour of Monazite-(La) at high pressure: a first principles study by Motsomone Lebogang, Diale Ramogohlo, Ngoepe Phuti, Bissett Hertzog, Chauke Hasani

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First-Principles Study on the Effect of Lithiation in Spinel Li_xMn₂O₄ (0 ≤ x ≤ 1) Structure: Calibration of CASTEP and ONETEP Simulation Codes by Donald Hlungwani, Raesibe Sylvia Ledwaba, Phuti Esrom Ngoepe

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Electronic stability study of tin dioxide as a catalyst for lithium-air batteries by Maenetja Khomotso, Ngoepe Phuti

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Structural and mechanical properties of monazite type LnPO4 (Ln = La, Ce, Pr and Nd) by Motsomone Lebogang, Diale Ramogohlo, Ngoepe Phuti, Koen Renier, Chauke Hasani

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Computational studies of structural, mechanical and magnetic properties of the B2-phase Fe50Co50-xCrx magnetic alloys by Ledwaba Tebogo, Diale Ramogohlo, Ngoepe Phuti, Chauke Hasani

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First principle studies on stability of reactive products of Li-O and Li-S batteries by Masedi Cliffton, Ngoepe Phuti

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Using a Gaussian model to estimate the level of particle matter concentration on paved and unpaved roads in urban environment: A case study by Ngangmo Yannick Cédric, Mezoue Adiang Cyrille, Mah Serges Charitos, Monkam David

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Analysing the Implications of Charging on Nanostructured Li₂MnO₃ Cathode Materials for Lithium-Ion Battery Performance by Tshidi Mogashoa, Raesibe Sylvia Ledwaba, Phuti Esrom Ngoepe

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Semi-automatic staging area for high-quality structured data extraction from scientific literature by Luca Foppiano, Tomoya Mato, Kensei Terashima, Pedro Ortiz Suarez, Taku Tou, Chikako Sakai, Wei-Sheng Wang, Toshiyuki Amagasa, Yoshihiko Takano, Masashi Ishii

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Development and Validation of a New Near-Infrared Sensor to Measure Polyethylene Glycol (PEG) Concentration in Water by Olivier Buzzi, Shengyang Yuan, Benjamin Routley

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Compositional Dependence of Magnetocrystalline Anisotropy, Magnetic Moments, and Energetic and Electronic Properties on Fe-Pt Alloys by Ndanduleni Lethole, Phuti Ngoepe, Hasani Chauke

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Special Issue “Theoretical Calculation and Molecular Modeling of Nanomaterials” by Frederik Tielens

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