نتائج البحث - "Ning, Jinliang"

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Towards chemical accuracy for chemi- and physisorption with an efficient density functional

المؤلفون: Kothakonda, Manish, Zhang, Ruiqi, Ning, Jinliang, Furness, James, Patra, Abhirup, Zhao, Qing, Sun, Jianwei

مصطلحات موضوعية: Condensed Matter - Materials Science, Physics - Chemical Physics

URL الوصول: http://arxiv.org/abs/2410.11248

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Comparing first-principles density functionals plus corrections for the lattice dynamics of YBa$_2$Cu$_3$O$_6$

المؤلفون: Ning, Jinliang, Lane, Christopher, Barbiellini, Bernardo, Markiewicz, Robert S., Bansil, Arun, Ruzsinszky, Adrienn, Perdew, John P., Sun, Jianwei

المصدر: J. Chem. Phys. 160, 064106 (2024)

مصطلحات موضوعية: Condensed Matter - Materials Science, Condensed Matter - Strongly Correlated Electrons, Condensed Matter - Superconductivity

URL الوصول: http://arxiv.org/abs/2310.12259

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3

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Evidence of Weyl Fermion Enhanced Thermal Conductivity Under Magnetic Fields in Antiferromagnetic Topological Insulator Mn(Bi(1-x)Sb(x))2Te4

المؤلفون: Robinson, Robert A., Lee, Seng Huat, Min, Lujin, Ning, Jinliang, Sun, Jianwei, Mao, Zhiqiang

مصطلحات موضوعية: Condensed Matter - Materials Science, Condensed Matter - Mesoscale and Nanoscale Physics

URL الوصول: http://arxiv.org/abs/2304.06154

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4

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High-throughput screening assisted discovery of a stable layered anti-ferromagnetic semiconductor: CdFeP2Se6

المؤلفون: Kothakonda, Manish, Zhu, Yanglin, Guan, Yingdong, He, Jingyang, Kidd, Jamin, Zhang, Ruiqi, Ning, Jinliang, Gopalan, Venkatraman, Xie, Weiwei, Mao, Zhiqiang, Sun, Jianwei

المصدر: Adv. Funct. Mater. 2023, 2210965

مصطلحات موضوعية: Condensed Matter - Materials Science

URL الوصول: http://arxiv.org/abs/2212.06289

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5

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Critical role of magnetic moments on lattice dynamics in YBa${}_{2}$Cu${}_{3}$O${}_{6}$

المؤلفون: Ning, Jinliang, Lane, Christopher, Zhang, Yubo, Matzelle, Matthew, Singh, Bahadur, Barbiellini, Bernardo, Markiewicz, Robert S., Bansil, Arun, Sun, Jianwei

المصدر: Phys. Rev. B 107, 045126 (2023)

مصطلحات موضوعية: Condensed Matter - Superconductivity, Condensed Matter - Materials Science, Condensed Matter - Strongly Correlated Electrons

URL الوصول: http://arxiv.org/abs/2210.06569

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6

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Testing the r$^2$SCAN density functional for the thermodynamic stability of solids with and without a van der Waals correction

المؤلفون: Kothakonda, Manish, Kaplan, Aaron D., Isaacs, Eric B., Bartel, Christopher J., Furness, James W., Ning, Jinliang, Wolverton, Chris, Perdew, John P., Sun, Jianwei

مصطلحات موضوعية: Condensed Matter - Materials Science, Physics - Chemical Physics

URL الوصول: http://arxiv.org/abs/2208.02841

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7

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Workhorse minimally-empirical dispersion-corrected density functional, with tests for weakly-bound systems: r$^{2}$SCAN+rVV10

المؤلفون: Ning, Jinliang, Kothakonda, Manish, Furness, James W., Kaplan, Aaron D., Ehlert, Sebastian, Brandenburg, Jan Gerit, Perdew, John P., Sun, Jianwei

مصطلحات موضوعية: Condensed Matter - Materials Science, Condensed Matter - Soft Condensed Matter, Physics - Atomic and Molecular Clusters, Physics - Computational Physics

URL الوصول: http://arxiv.org/abs/2204.11717

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8

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Construction of meta-GGA functionals through restoration of exact constraint adherence to regularized SCAN functionals

المؤلفون: Furness, James W., Kaplan, Aaron D., Ning, Jinliang, Perdew, John P., Sun, Jianwei

مصطلحات موضوعية: Condensed Matter - Materials Science, Physics - Chemical Physics, Physics - Computational Physics

URL الوصول: http://arxiv.org/abs/2110.00647

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9

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Reliable lattice dynamics from an efficient density functional

المؤلفون: Ning, Jinliang, Furness, James W., Sun, Jianwei

المصدر: Chem. Mater. 2022, 34, 6, 2562-2568

مصطلحات موضوعية: Condensed Matter - Materials Science

URL الوصول: http://arxiv.org/abs/2107.11850

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10

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r2SCAN-D4: Dispersion corrected meta-generalized gradient approximation for general chemical applications

المؤلفون: Ehlert, Sebastian, Huniar, Uwe, Ning, Jinliang, Furness, James W., Sun, Jianwei, Kaplan, Aaron D., Perdew, John P., Brandenburg, Jan Gerit

المصدر: J. Chem. Phys. 154, 061101 (2021)

مصطلحات موضوعية: Physics - Chemical Physics

URL الوصول: http://arxiv.org/abs/2012.09249

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11

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Accurate and numerically efficient r$^2$SCAN meta-generalized gradient approximation

المؤلفون: Furness, James W., Kaplan, Aaron D., Ning, Jinliang, Perdew, John P., Sun, Jianwei

مصطلحات موضوعية: Condensed Matter - Materials Science, Physics - Chemical Physics

URL الوصول: http://arxiv.org/abs/2008.03374

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12

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Sensitivity of the electronic and magnetic structures of cuprate superconductors to density functional approximations

المؤلفون: Pokharel, Kanun, Lane, Christopher, Furness, James W., Zhang, Ruiqi, Ning, Jinliang, Barbiellini, Bernardo, Markiewicz, Robert S., Zhang, Yubo, Bansil, Arun, Sun, Jianwei

مصطلحات موضوعية: Condensed Matter - Superconductivity

URL الوصول: http://arxiv.org/abs/2004.08047

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13

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Examining the order-of-limits problem and lattice constant performance of the Tao--Mo Functional

المؤلفون: Furness, James W, Sengupta, Niladri, Ning, Jinliang, Ruzsinszky, Adrienn, Sun, Jianwei

مصطلحات موضوعية: Physics - Chemical Physics

URL الوصول: http://arxiv.org/abs/2004.01773

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14

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Subtle metastability of the layered magnetic topological insulator MnBi2Te4 from weak interactions

المؤلفون: Ning, Jinliang, Zhu, Yanglin, Kidd, Jamin, Guan, Yingdong, Wang, Yu, Mao, Zhiqiang, Sun, Jianwei

مصطلحات موضوعية: Condensed Matter - Materials Science

URL الوصول: http://arxiv.org/abs/1912.01173

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15

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High yield production of ultrathin fibroid semiconducting nanowire of Ta$_2$Pd$_3$Se$_8$

المؤلفون: Liu, Xue, Liu, Sheng, Antipina, Liubov Yu., Zhu, Yibo, Ning, Jinliang, Liu, Jinyu, Yue, Chunlei, Joshy, Abin, Zhu, Yu, Sun, Jianwei, Sanchez, Ana M, Sorokin, Pavel B., Mao, Zhiqiang, Xiong, Qihua, Wei, Jiang

مصطلحات موضوعية: Physics - Applied Physics, Condensed Matter - Materials Science

URL الوصول: http://arxiv.org/abs/1911.06746

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16

Academic Journal

Comparing first-principles density functionals plus corrections for the lattice dynamics of YBa2Cu3O6.

المؤلفون: Ning, Jinliang, Lane, Christopher, Barbiellini, Bernardo, Markiewicz, Robert S., Bansil, Arun, Ruzsinszky, Adrienn, Perdew, John P., Sun, Jianwei

المصدر: Journal of Chemical Physics; 2/14/2024, Vol. 160 Issue 6, p1-9, 9p

مصطلحات موضوعية: DENSITY functionals, LATTICE dynamics, MATERIALS science, CUPRATES, PHONONS, SUPERCONDUCTIVITY

17

Academic Journal

Assessing r²SCAN meta-GGA functional for structural parameters, cohesive energy, mechanical modulus, and thermophysical properties of 3d, 4d, and 5d transition metals.

المؤلفون: Liu, Haoliang, Bai, Xue, Ning, Jinliang, Hou, Yuxuan, Song, Zifeng, Ramasamy, Akilan, Zhang, Ruiqi, Li, Yefei, Sun, Jianwei, Xiao, Bing

المصدر: Journal of Chemical Physics; 1/14/2024, Vol. 160 Issue 2, p1-11, 11p

مصطلحات موضوعية: THERMOPHYSICAL properties, TRANSITION metals, TRANSITION metal alloys, DENSITY functionals, TRANSITION metal compounds, INTERMETALLIC compounds

18

Academic Journal

Vertical Ionization Energies, Generalized Kohn–Sham Orbital Energies, and the Curious Case of the Copper Oxide Anions.

المؤلفون: Shahi, Chandra, Maniar, Rohan, Ning, Jinliang, Csonka, Gábor I., Perdew, John P., Ruzsinszky, Adrienn

المصدر: Journal of Physical Chemistry A; 10/10/2024, Vol. 128 Issue 40, p8628-8634, 7p

19

Academic Journal

Sensitivity of the electronic and magnetic structures of cuprate superconductors to density functional approximations

المؤلفون: Pokharel, Kanun, Lane, Christopher, Furness, James W., Zhang, Ruiqi, Ning, Jinliang, Barbiellini, Bernardo, Markiewicz, Robert S., Zhang, Yubo, Bansil, Arun, Sun, Jianwei

المصدر: npj Computational Materials ; volume 8, issue 1 ; ISSN 2057-3960

الاتاحة: http://dx.doi.org/10.1038/s41524-022-00711-z
https://www.nature.com/articles/s41524-022-00711-z.pdf
https://www.nature.com/articles/s41524-022-00711-z

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20

Academic Journal

Testing the r 2 SCAN Density Functional for the Thermodynamic Stability of Solids with and without a van der Waals Correction

المؤلفون: Kothakonda, Manish, Kaplan, Aaron D., Isaacs, Eric B., Bartel, Christopher J., Furness, James W., Ning, Jinliang, Wolverton, Chris, Perdew, John P., Sun, Jianwei

المساهمون: Basic Energy Sciences, Air Force Office of Scientific Research, Temple University, Division of Materials Research

المصدر: ACS Materials Au ; volume 3, issue 2, page 102-111 ; ISSN 2694-2461 2694-2461

الاتاحة: http://dx.doi.org/10.1021/acsmaterialsau.2c00059
https://pubs.acs.org/doi/pdf/10.1021/acsmaterialsau.2c00059

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