Three-dimensional magnetism and coupling to the conduction electrons in PdCrO2
被引:14
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作者:
Ong, Khuong P.
论文数: 0引用数: 0
h-index: 0
机构:
Inst High Performance Comp, Singapore 138632, SingaporeInst High Performance Comp, Singapore 138632, Singapore
Ong, Khuong P.
[1
]
Singh, David J.
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h-index: 0
机构:
Oak Ridge Natl Lab, Mat Sci & Technol Div, Oak Ridge, TN 37831 USAInst High Performance Comp, Singapore 138632, Singapore
Singh, David J.
[2
]
机构:
[1] Inst High Performance Comp, Singapore 138632, Singapore
[2] Oak Ridge Natl Lab, Mat Sci & Technol Div, Oak Ridge, TN 37831 USA
来源:
PHYSICAL REVIEW B
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2012年
/
85卷
/
13期
关键词:
LATTICE;
OXIDES;
D O I:
10.1103/PhysRevB.85.134403
中图分类号:
T [工业技术];
学科分类号:
08 ;
摘要:
We report density functional calculations addressing the electronic structure and magnetic properties of delafossite PdCrO2. We find substantial magnetic interactions in the c-axis direction as well as beyond first nearest neighbors in-plane, so that PdCrO2 is a three-dimensional (3D) frustrated antiferromagnet. We also find substantial coupling between the Cr moments and the Pd derived conduction electrons.
机构:
E China Normal Univ, Inst Theoret Phys, Shanghai 200062, Peoples R China
E China Normal Univ, Dept Phys, Shanghai 200062, Peoples R China
Natl Univ Singapore, Dept Phys, Singapore 117542, Singapore
Natl Univ Singapore, Ctr Computat Sci & Engn, Singapore 117542, SingaporeE China Normal Univ, Inst Theoret Phys, Shanghai 200062, Peoples R China
Liu, Zonghua
Li, Baowen
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h-index: 0
机构:
Natl Univ Singapore, Dept Phys, Singapore 117542, Singapore
Natl Univ Singapore, Ctr Computat Sci & Engn, Singapore 117542, Singapore
NUS, Grad Sch Integrat Sci & Engn, Singapore 117597, SingaporeE China Normal Univ, Inst Theoret Phys, Shanghai 200062, Peoples R China
机构:
Inst Appl Phys & Computat Math, Beijing 100094, Peoples R China
CAEP Software Ctr High Performance Numer Simulat, Beijing 100088, Peoples R ChinaInst Appl Phys & Computat Math, Beijing 100094, Peoples R China
Wu, Quansheng
Sacksteder, Vincent E.
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h-index: 0
机构:
Chinese Acad Sci, Inst Phys, Beijing 100190, Peoples R China
Nanyang Technol Univ, Div Phys & Appl Phys, Singapore 637371, SingaporeInst Appl Phys & Computat Math, Beijing 100094, Peoples R China
机构:
Fuzhou Univ, Dept Phys, Fuzhou 350108, Fujian, Peoples R China
Fujian Sci & Technol Innovat Lab Optoelect Inform, Fuzhou 350108, Fujian, Peoples R ChinaFuzhou Univ, Dept Phys, Fuzhou 350108, Fujian, Peoples R China
Luo, Rongxiang
Huang, Lisheng
论文数: 0引用数: 0
h-index: 0
机构:
Fuzhou Univ, Dept Phys, Fuzhou 350108, Fujian, Peoples R China
Fujian Sci & Technol Innovat Lab Optoelect Inform, Fuzhou 350108, Fujian, Peoples R ChinaFuzhou Univ, Dept Phys, Fuzhou 350108, Fujian, Peoples R China
Huang, Lisheng
Lepri, Stefano
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h-index: 0
机构:
CNR, Ist Sistemi Complessi, Via Madonna del Piano 10, I-50019 Sesto Fiorentino, Italy
Ist Nazl Fis Nucl, Sez Firenze, Via G Sansone 1, I-50019 Sesto Fiorentino, ItalyFuzhou Univ, Dept Phys, Fuzhou 350108, Fujian, Peoples R China