基本情况
孙博，北京应用物理与计算数学研究所，副研究员。负责完成中国工程物理研究院科学技术发展基金一项，主持在研国家自然科学青年基金项目一项。
研究领域
计算材料学
教育背景
2006年9月至2009年7月 博士，中国工程物理研究院北京研究生部
2003年9月至2006年7月 硕士，北京师范大学
1999年9月至2003年7月 学士，山东师范大学
论文发表
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B. Sun*, H.-F. Liu, H.-F. Song, G. Zhang,
H. Zheng, X.-G. Zhao, and P. Zhang*, “Environmental dependence of redox
energetices of PuO2 and α-Pu2O3: A quantitative solution from DFT+U
calculations,” Phys. Lett. A 376, 2672 (2012)
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B. Sun*, H.-F. Liu, H.-F. Song, G. Zhang,
H. Zheng, X.-G. Zhao, and P. Zhang*, “First-principles study of surface
properties of PuO2: Effects of thickness and O-vacancy on surface stability and
chemical activity,” J. Nucl. Mater. 426, 139 (2012)
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C.-L. Song, B. Sun, Y.-L. Wang, Y.-P.
Jiang, L. Wang, K. He, X. Chen, P. Zhang, X.-C. Ma*, and Q.-K. Xue*,
“Charge-transfer-induced cesium superlattices on graphene,” Phys. Rev. Lett.
108, 156803 (2012)
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Z. Hu, Y. Yang, B. Sun, P. Zhang*, W. Wang,
and X. H. Shao*, “Quantum size effect on the dissociation of O2 molecules on
ultrathin Pb(111) films,” Chin. Phys. B 21, 016801 (2012)
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H. Zheng*, L. Shen, B. Bai, B. Sun, “Quasi-exponent
relationship and amplification effects of surface component for NiAl compound”, Acta Phys.
Sin. (物理学报), 61(01), 016104 (2012)
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Y. Li, Y. Yang, B. Sun, Y. H. Wei, and P.
Zhang*, “Dissociation of hydrogen molecules on the clean and
hydrogen-preadsorbed Be(0001) surface,” Phys. Lett. A 375, 2430 (2011)
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Z. Hu, Y. Yang, B. Sun, X. H. Shao, W.
Wang, and P. Zhang*, “Quantum oscillations in adsorption energetics of atomic
oxygen on Pb(111) ultrathin films: A density-functional theory study,” J. Chem.
Phys. 132, 024703 (2010)
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Y. Li, Y. Yang, B. Sun, H. Song, Y. H. Wei,
and P. Zhang*, “Rotation of hydrogen molecules during the dissociative
adsorption on the Mg(0001) surface: A first-principles study,” Chin. Phys. B
19(5), 058201 (2010)
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S. X. Wang, Y. Yang, B. Sun, R. W. Li, S.
J. Liu, and P. Zhang*, “Adsorption properties of N2 on Be(0001) surface: A
first-principles calculation,” Mod. Phys. Lett. B 24, 859 (2010)
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B.-T. Wang, P. Zhang*, H. L. Shi, B. Sun,
and W. D. Li, “Mechanical and chemical bonding properties of ground state
BeH2,” Eur. Phys. J. B 74, 303 (2010)
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H. L. Shi, P. Zhang*, S. S. Li, B. T. Wang,
and B. Sun, “First-principles study of UC2 and U2C3,” J. Nucl. Mater. 396, 218 (2010)
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C.-L. Song, Y.-L. Wang, Y.-X. N., J.-F.
Jia, X. Chen, B. Sun, P. Zhang, Q.-K. Xue* and X. C. Ma, “Tailoring
phthalocyanine metalation reaction by quantum size effect,” J. Am. Chem. Soc.
132,1456 (2010)
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P. Zhang*, B. Sun, and Y. Yang, “Adsorption
and dissociation of O2 at Be(0001): First-principles prediction of an energy
barrier on the adiabatic potential energy surface”, Phys. Rev. B 79, 165416
(2009)
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J.-Y. Yan, P. Zhang*, B. Sun, H. Lu, Z.
Wang, S. Q. Duan, and X.-G. Zhao, “Quantum blockade and loop current induced by
a single lattice defect in graphene nanoribbons”, Phys. Rev. B 79, 115403
(2009)
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S. X. Wang, Y. Yang, B. Sun, R. W. Li, S.
J. Liu, and P. Zhang*, “Activated molecular adsorption of CO on the Be (0001)
surface: A density-functional theory study,” Phys. Rev. B 80, 115434 (2009)
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Y. Li, P. Zhang*, B. Sun, Y. Yang, and Y.
H. Wei, “Atomic hydrogen adsorption and incipient hydrogenation of the Mg(0001)
surface: A density-functional theory study,” J. Chem. Phys. 131, 034706 (2009)
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H. L. Shi, P. Zhang*, S. S. Li, B. Sun, and
B. T. Wang, “Electronic structures and mechanical properties of uranium
monocarbide from first-principles LDA+U and GGA+U calculations,” Phys. Lett. A
373, 3577 (2009)
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B. Sun, P. Zhang*, Z. Wang, S. Q. Duan,
X.-G. Zhao, X. C. Ma, and Q.-K. Xue, “Oxygen adsorption and incipient oxidation
of the Pb(111) surface: A density-functional theory study”, Phys. Rev. B 78,
035421 (2008)
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B. Sun, P. Zhang*, and X.-G. Zhao,
“First-principles local density approximation + U and generalized gradient
approximation + U study of plutonium oxides”, J. Chem. Phys. 128, 084705 (2008)
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B. Sun, and P. Zhang*, “First-principles
LDA+U and GGA+U study of plutonium oxides”, Chin. Phys. B 17, 1364 (2008)