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Electronic, Elastic, Vibrational and Thermodynamic Properties of HfIrX (X = As, Sb and Bi) Compounds: Insights from DFT-Based Computer Simulation
Arikan, Nihat; Dikici Yildiz, Gokcen; Yildiz, Yasin Gokturk; Iyigor, Ahmet (SPRINGER, 2020)Ab-initio calculations were performed to reveal and thoroughly understand the structural, electronic, elastic, thermodynamic and vibrational properties of HfIrX (X = As, Sb and Bi) compounds in the C1(b) phase. Basic ...
