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The last 5 uploaded publications
Advances and Challenges of <scp>SCAN</scp> and <scp>r<sup>2</sup>SCAN</scp> Density Functionals in Transition‐Metal Compounds
Yubo Zhang, Akilan Ramasamy, Kanun Pokharel, Manish Kothakonda, Bing Xiao, James W. Furness, Jinliang Ning, Ruiqi Zhang, Jianwei Sun (2025). Advances and Challenges of <scp>SCAN</scp> and <scp>r<sup>2</sup>SCAN</scp> Density Functionals in Transition‐Metal Compounds. , 15(2), DOI: https://doi.org/10.1002/wcms.70007.
Article39 days agoComparing first-principles density functionals plus corrections for the lattice dynamics of YBa2Cu3O6
Jinliang Ning, Christopher Lane, B. Barbiellini, R. S. Markiewicz, Arun Bansil, Adrienn Ruzsinszky, John P Perdew, Jianwei Sun (2024). Comparing first-principles density functionals plus corrections for the lattice dynamics of YBa2Cu3O6. , 160(6), DOI: https://doi.org/10.1063/5.0181349.
Article39 days agoAssessing r2SCAN meta-GGA functional for structural parameters, cohesive energy, mechanical modulus, and thermophysical properties of 3<i>d</i>, 4<i>d</i>, and 5<i>d</i> transition metals
Haoliang Liu, Xue Bai, Jinliang Ning, Yuxuan Hou, Zifeng Song, Akilan Ramasamy, Ruiqi Zhang, Yingfan Li, Jianwei Sun, Bing Xiao (2024). Assessing r2SCAN meta-GGA functional for structural parameters, cohesive energy, mechanical modulus, and thermophysical properties of 3<i>d</i>, 4<i>d</i>, and 5<i>d</i> transition metals. , 160(2), DOI: https://doi.org/10.1063/5.0176415.
Article39 days agoCorrection to “Layered Semiconductor Cr<sub>0.32</sub>Ga<sub>0.68</sub>Te<sub>2.33</sub> with Concurrent Broken Inversion Symmetry and Ferromagnetism: A Bulk Ferrovalley Material Candidate”
Yingdong Guan, Leixin Miao, Jingyang He, Jinliang Ning, Yangyang Chen, Weiwei Xie, Jianwei Sun, Venkatraman Gopalan, Jun Zhu, Xiaoping Wang, Nasim Alem, Qiang Zhang, Zhiqiang Mao (2023). Correction to “Layered Semiconductor Cr<sub>0.32</sub>Ga<sub>0.68</sub>Te<sub>2.33</sub> with Concurrent Broken Inversion Symmetry and Ferromagnetism: A Bulk Ferrovalley Material Candidate”. , 145 (39), DOI: https://doi.org/10.1021/jacs.3c09488.
Corrigendum39 days agoCritical role of magnetic moments in the lattice dynamics of <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:msub><mml:mrow><mml:mi>YBa</mml:mi></mml:mrow><mml:mn>2</mml:mn></mml:msub><mml:msub><mml:mrow><mml:mi>Cu</mml:mi></mml:mrow><mml:mn>3</mml:mn></mml:msub><mml:msub><mml:mrow><mml:mi mathvariant="normal">O</mml:mi></mml:mrow><mml:mn>6</mml:mn></mml:msub></mml:math>
Jinliang Ning, Christopher Lane, Yubo Zhang, Matthew Matzelle, Bahadur Singh, B. Barbiellini, R. S. Markiewicz, Arun Bansil, Jianwei Sun (2023). Critical role of magnetic moments in the lattice dynamics of <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:msub><mml:mrow><mml:mi>YBa</mml:mi></mml:mrow><mml:mn>2</mml:mn></mml:msub><mml:msub><mml:mrow><mml:mi>Cu</mml:mi></mml:mrow><mml:mn>3</mml:mn></mml:msub><mml:msub><mml:mrow><mml:mi mathvariant="normal">O</mml:mi></mml:mrow><mml:mn>6</mml:mn></mml:msub></mml:math>. , 107(4), DOI: https://doi.org/10.1103/physrevb.107.045126.
Article39 days ago