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CN 11-5639/O4
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Other articles related with "71.15.Nc":
126802 Jinli Cao, Wen Yang, Xinfu He
  Segregation behavior and embrittling effect of lanthanide La, Ce, Pr, and Nd at Σ3(111) tilt symmetric grain boundary in α-Fe
    Chin. Phys. B   2019 Vol.28 (12): 126802-126802 [Abstract] (83) [HTML 1 KB] [PDF 979 KB] (67)
127101 Xiuwen Zhang
  Theoretical design of multifunctional half-Heusler materials based on first-principles calculations
    Chin. Phys. B   2018 Vol.27 (12): 127101-127101 [Abstract] (325) [HTML 1 KB] [PDF 3571 KB] (515)
117101 Jin-Ping Li, Song-He Meng, Han-Tao Lu, Takami Tohyama
  First-principles study on the mechanics, optical, and phonon properties of carbon chains
    Chin. Phys. B   2018 Vol.27 (11): 117101-117101 [Abstract] (212) [HTML 1 KB] [PDF 653 KB] (120)
118801 Gen-Cai Guo, Changhao Wang, Bang-Ming Ming, Si-Wei Luo, Heng Su, Bo-Ya Wang, Ming Zhang, Hai-Jun Yu, Ru-Zhi Wang
  High capacity sodium-rich layered oxide cathode for sodium-ion batteries
    Chin. Phys. B   2018 Vol.27 (11): 118801-118801 [Abstract] (256) [HTML 1 KB] [PDF 1621 KB] (200)
97102 Baokun Lu, Chong-Yu Wang, Zhihui Du
  Site preferences of alloying transition metal elements in Ni-based superalloy: A first-principles study
    Chin. Phys. B   2018 Vol.27 (9): 97102-097102 [Abstract] (195) [HTML 1 KB] [PDF 936 KB] (158)
86302 Guang-Wei Peng, Xue-Ping Gan, Zhou Li, Ke-Chao Zhou
  First-principles study of the (CuxNi1-x)3Sn precipitations with different structures in Cu-Ni-Sn alloys
    Chin. Phys. B   2018 Vol.27 (8): 86302-086302 [Abstract] (158) [HTML 1 KB] [PDF 2527 KB] (131)
37104 S Benlamari, H Bendjeddou, R Boulechfar, S Amara Korba, H Meradji, R Ahmed, S Ghemid, R Khenata, S Bin Omran
  Structural, electronic, elastic, and thermal properties of CaNiH3 perovskite obtained from first-principles calculations
    Chin. Phys. B   2018 Vol.27 (3): 37104-037104 [Abstract] (195) [HTML 1 KB] [PDF 581 KB] (294)
106103 Wei Xiao, Lu Sun, Shu-Hui Huang, Jian-Wei Wang, Lei Cheng, Li-Gen Wang
  Stability and mechanical properties of various Hf-H phases:A density-functional theory study
    Chin. Phys. B   2017 Vol.26 (10): 106103-106103 [Abstract] (95) [HTML 1 KB] [PDF 312 KB] (133)
76801 Jin-Li Cao, Bing-Ling He, Wei Xiao, Li-Gen Wang
  Effects of the Be22W phase formation on hydrogen retention and blistering in mixed Be/W systems
    Chin. Phys. B   2017 Vol.26 (7): 76801-076801 [Abstract] (151) [HTML 1 KB] [PDF 1028 KB] (174)
79101 Jian Zhao, Man-Chao He, Xiang-Xing Hu, Wei Gao
  Density functional theory investigation of carbon monoxide adsorption on the kaolinite (001) surface
    Chin. Phys. B   2017 Vol.26 (7): 79101-079101 [Abstract] (159) [HTML 1 KB] [PDF 1500 KB] (170)
67103 Li Xue, Yi-Ming Ren, Jun-Rong He, Si-Liu Xu
  First-principles investigation of the effects of strain on elastic, thermal, and optical properties of CuGaTe2
    Chin. Phys. B   2017 Vol.26 (6): 67103-067103 [Abstract] (166) [HTML 1 KB] [PDF 580 KB] (308)
17103 Jian Zhang(张健), Ming-Feng Tian(田明锋), Guang-Xi Jin(金光希), Yuan-Feng Xu(徐远锋), Xi Dai(戴希)
  Implementation of LDA+Gutzwiller with Newton's method
    Chin. Phys. B   2017 Vol.26 (1): 17103-017103 [Abstract] (282) [HTML 1 KB] [PDF 602 KB] (337)
123101 Hong-Xia Liu, Fu-Ling Tang, Hong-Tao Xue, Yu Zhang, Yu-Wen Cheng, Yu-Dong Feng
  Lattice structures and electronic properties of WZ-CuInS2/WZ-CdS interface from first-principles calculations
    Chin. Phys. B   2016 Vol.25 (12): 123101-123101 [Abstract] (180) [HTML 1 KB] [PDF 3247 KB] (322)
116801 Bing-Ling He, Jin-Long Wang, Zhi-Xue Tian, Li-Juan Jiang, Wei Song, Bin Wang
  First-principles study of He trapping in η-Fe2C
    Chin. Phys. B   2016 Vol.25 (11): 116801-116801 [Abstract] (147) [HTML 1 KB] [PDF 1066 KB] (221)
107104 Meng-Li Huang, Chong-Yu Wang
  First-principles studies of effects of interstitial boron and carbon on the structural, elastic, and electronic properties of Ni solution and Ni3Al intermetallics
    Chin. Phys. B   2016 Vol.25 (10): 107104-107104 [Abstract] (158) [HTML 1 KB] [PDF 792 KB] (252)
97103 Zeng Fan, Zhang Wei-Bing, Tang Bi-Yu
  Electronic structures and elastic properties of monolayer and bilayer transition metal dichalcogenides MX2 (M= Mo, W; X= O, S, Se, Te): A comparative first-principles study
    Chin. Phys. B   2015 Vol.24 (9): 97103-097103 [Abstract] (429) [HTML 1 KB] [PDF 4138 KB] (1241)
86201 Wang Chen-Ju, Gu Jian-Bing, Kuang Xiao-Yu, Yang Xiang-Dong
  Accurate calculations of the high-pressure elastic constants based on the first-principles
    Chin. Phys. B   2015 Vol.24 (8): 86201-086201 [Abstract] (283) [HTML 1 KB] [PDF 280 KB] (339)
86401 Pan Dou-Xing, Wang Tzu-Chiang, Guo Wan-Lin
  Bending-induced phase transition in monolayer black phosphorus
    Chin. Phys. B   2015 Vol.24 (8): 86401-086401 [Abstract] (351) [HTML 1 KB] [PDF 1754 KB] (612)
77102 Liu Li-Li, Wu Xiao-Zhi, Wang Rui, Li Wei-Guo, Liu Qing
  Stacking fault energy, yield stress anomaly, and twinnability of Ni3Al: A first principles study
    Chin. Phys. B   2015 Vol.24 (7): 77102-077102 [Abstract] (237) [HTML 1 KB] [PDF 4397 KB] (457)
26801 Lu Zhan-Sheng, He Bing-Ling, Ma Dong-Wei, Yang Zong-Xian
  Coadsorption of gold with chlorine on CeO2 (111) surfaces: A first principles study
    Chin. Phys. B   2015 Vol.24 (2): 26801-026801 [Abstract] (219) [HTML 0 KB] [PDF 1286 KB] (401)
117102 Li Chun-Xia, Dang Sui-Hu, Wang Li-Ping, Zhang Cai-Li, Han Pei-De
  First-principles study of the effects of selected interstitial atoms on the generalized stacking fault energies, strength, and ductility of Ni
    Chin. Phys. B   2014 Vol.23 (11): 117102-117102 [Abstract] (242) [HTML 1 KB] [PDF 512 KB] (448)
37102 Li Chun-Xia, Dang Sui-Hu, Wang Li-Ping, Zhang Cai-Li, Han Pei-De
  Effect of Cr, Mo, and Nb additions on intergranular cohesion of ferritic stainless steel:First-principles determination
    Chin. Phys. B   2014 Vol.23 (3): 37102-037102 [Abstract] (214) [HTML 1 KB] [PDF 1778 KB] (454)
37103 Xue Li, Xu Bin, Yi Lin
  Electronic structures and thermoelectric properties of solid solutions CuGa1-xInxTe2:A first-principles study
    Chin. Phys. B   2014 Vol.23 (3): 37103-037103 [Abstract] (133) [HTML 1 KB] [PDF 457 KB] (466)
87101 Janusz Chrzanowski
  Some corrections to the Thomas–Fermi theory
    Chin. Phys. B   2013 Vol.22 (8): 87101-087101 [Abstract] (240) [HTML 1 KB] [PDF 11289 KB] (4433)
46202 Haci Ozisik, Engin Deligoz, Kemal Colakoglu, Gokhan Surucu
  Structural and mechanical stability of rare-earth diborides
    Chin. Phys. B   2013 Vol.22 (4): 46202-046202 [Abstract] (287) [HTML 1 KB] [PDF 207 KB] (1131)
118102 Han Zhi-Dong, Li Xiu-Yan, Yang Zhi, Liu Rui-Ping, Liu Shao-Ding, Zhang Ying
  Structures and magnetic properties of Fe and Ni monoatomic chains encapsulated by Au nanotube
    Chin. Phys. B   2012 Vol.21 (11): 118102-118102 [Abstract] (735) [HTML 1 KB] [PDF 937 KB] (728)
106301 E. Deligoz, K. Colakoglu, Y. O. Ciftci
  Lattice dynamical and thermodynamical properties of ReB2, RuB2, and OsB2 compounds in the ReB2 structure
    Chin. Phys. B   2012 Vol.21 (10): 106301-106301 [Abstract] (693) [HTML 1 KB] [PDF 1571 KB] (1044)
56102 Zhang Meng,Feng Xiao-Juan,Zhao Li-Xia,Zhang Hong-Yu,Luo You-Hua
  High stability of the goldalloy fullerenes:A density functional theory investigation of M12@Au20 (M=Na, Al, Ag, Sc, Y, La, Lu, and Au) clusters
    Chin. Phys. B   2012 Vol.21 (5): 56102-056102 [Abstract] (1118) [HTML 1 KB] [PDF 985 KB] (782)
57106 Zhao Jian-Zhou,Zhuang Jia-Ning,Deng Xiao-Yu,Bi Yan,Cai Ling-Cang,Fang Zhong,Dai Xi
  Implementation of LDA+DMFT with the pseudo-potential-plane-wave method
    Chin. Phys. B   2012 Vol.21 (5): 57106-057106 [Abstract] (1178) [HTML 1 KB] [PDF 1088 KB] (960)
36102 Hacini K,Meradji H,Ghemid S,El Haj Hassan F
  Theoretical prediction of structural, electronic and optical properties of quaternary alloy Zn1-xBexSySe1-y
    Chin. Phys. B   2012 Vol.21 (3): 36102-036102 [Abstract] (628) [HTML 1 KB] [PDF 390 KB] (968)
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