Feature-Rich Geometric and Electronic Properties of Carbon Nanoscrolls by Shih-Yang Lin, Sheng-Lin Chang, Cheng-Ru Chiang, Wei-Bang Li, Hsin-Yi Liu, Ming-Fa Lin

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Optoelectronic Properties of Ultrathin Indium Tin Oxide Films: A First-Principle Study by Xiaoyan Liu, Lei Wang, Yi Tong

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Positive and Negative Contribution from Lead–Oxygen Groups and Halogen Atoms to Birefringence: A First Principles Investigation by Can Deng, Jialong Wang, Mei Hu, Xiuhua Cui, Haiming Duan, Peng Li, Ming-Hsien Lee

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Uncovering the structural and photoelectric properties of perovskite crystals by joint multifaceted characterization and theoretical analysis by Aochen Du, Xingke Zheng, Genzhuang Li, Yun Ye, Enguo Chen, Sheng Xu, Tailiang Guo

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Multiple metamagnetism, extreme magnetoresistance and nontrivial topological electronic structures in the magnetic semimetal candidate holmium monobismuthide by Z M Wu, Y R Ruan, F Tang, L Zhang, Y Fang, J-M Zhang, Z D Han, R J Tang, B Qian, X F Jiang

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Elastic and electronic properties of fluorite RuO₂ from first principle by Z.J. Yang, A.M. Guo, Y.D. Guo, J. Li, Z. Wang, Q. Liu, R.F. Linghu, X.D. Yang

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Sintering and microwave dielectric properties of LiCaPO4 ceramic: experiment and first principle calculation by Rui Peng, Yuanxun Li, Yu Peng, Hua Su, Yongcheng Lu, Minshu Chen, Fangyi Huang, Hanyu Zhang

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Rational Design of High-Performance Photocontrolled Molecular Switches Based on Chiroptical Dimethylcethrene: A Theoretical Study by Li Han, Mei Wang, Yifan Zhang, Bin Cui, Desheng Liu

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Study of the electronic and optical properties of doped gallium sulfide monolayer by first principles calculations by Raziehsadat Hosseini almadvari, Maryam Nayeri, Somayeh Fotoohi

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Effect of Ag Doping on Mechanical Properties of Cu₆Sn₅ Intermetallic Compounds by Biao Wang, Junxi Lu, Lingyan Zhao, Junjie Liao, Jikang Yan

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Giant magnetization canting due to symmetry breaking in zigzag Co chains on Ir(001) by B Dupé, J E Bickel, Y Mokrousov, F Otte, K von Bergmann, A Kubetzka, S Heinze, R Wiesendanger

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A Comprehensive Study on Physical Properties of Antiperovskite GeNCa3 by Selgin Al, Ahmet İyigör

Subjects: “…first principle calculations…”
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The Milesian School: the Relationship between Religion and Philosophy by Mykolas Degutis

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First-principle study on electronic and optical properties of (Al, P, Al-P) doped graphene by Kuo Zhao, Wenchao Zhang, Lei Peng, Min Jiang, Wenqiang Wang, Xunjun He, Yi Wang, Laixu Gao

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<i>Cognitio imperans</i>: l’ontologia e il dibattito sul primo principio in età moderna (Clauberg, Du Hamel, Tschirnhaus) by Alice Ragni

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A New Formulation for Damascius' Critique on the Neoplatonic Transcendent Principle by Mohammad Habibollahi, Ahmad Asgari

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Felsefî Düşüncede Bir Kavramı (Aristoteles ve Plotinus Felsefelerindeki Bir Kavramının İbn Sînâ Felsefesine Yansımaları) by Cevdet Kılıç

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First-principles calculations to investigate elastic properties, chemical bonds, electronic properties, magnetic properties, and phonon spectrum of CuNFe3 and CuNCo3 by Qi-Qi Liang, De-Yuan Hu, Tian-Yu Tang, Hua-Xu Gao, Shi-Quan Wu, Li Li, Qi Dai, Yan-Lin Tang

Subjects: “…First-principle…”
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First-principles calculations to investigate structural, electronic, optical and thermodynamic properties of anti-perovskite compounds X3OI(X = Na, K, Rb) by Qi-Qi Liang, De-Yuan Hu, Tian-Yu Tang, Hua-Xu Gao, Shi-Quan Wu, Li Li, Yan-Lin Tang

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Electronic Structure and Optical Properties of Co and Fe doped ZnO by Li Chunping, Gao Ge, Chen Xin

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