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Electronic structure and photoemission on VNi3
Institution:1. Institute of Macromolecular Chemistry, Academy of Sciences of the Czech Republic, Heyrovského nám. 2, 162 06 Prague 6, Czech Republic;2. Institute of Biomedical Engineering and Informatics (BMTI), Technische Universität Ilmenau, Gustav-Kirchhoff-Straße 2, 98693 Ilmenau, Germany;3. Department of Nano Biophotonics, Leibniz Institute of Photonic Technology (IPHT), Albert-Einstein-Straße 9, 07745 Jena, Germany;1. School of Materials Science and Engineering, Shaanxi Normal University, Xi''an, 710119, PR China;2. Institute of Chemical Sciences, Bahauddin Zakariya University, Multan, 60800, Pakistan;3. Department of Physics, Allama Iqbal Open University, Islamabad, Pakistan;4. Mechanical Engineering Department, College of Engineering, King Khalid University, Abha, 61421, Asir, Kingdom of Saudi Arabia;5. Research Center for Advanced Materials Science (RCAMS), King Khalid University, Guraiger, P.O. Box 9004, Abha, 61413, Asir, Kingdom of Saudi Arabia;6. Department of Physical Sport Science, College of Education, Princess Nourah bint Abdulrahman University, P.O. Box 84428, Riyadh, 11671, Saudi Arabia;7. Department of Chemistry, College of Science, Taif University, P.O. Box 11099, Taif, 21944, Saudi Arabia;8. Department of Physics, Government Post Graduate College, Nowshera, 24100, KP, Pakistan;9. Institute of Physics and Technology, Ural Federal University, Mira Str.19, 620002, Yekaterinburg, Russia;10. Department of Physics, Riphah International University, Islamabad, 44000, Pakistan;1. Department of Chemical Engineering, Faculty of Engineering, King Mongkut’s University of Technology North Bangkok, Bangkok 10800, Thailand;2. Center of Eco-Materials and Cleaner Technology, King Mongkut’s University of Technology North Bangkok, Bangkok 10800, Thailand;3. School of Chemical, Biological and Materials Engineering and Institute for Applied Surfactant Research, University of Oklahoma, Norman, OK, USA
Abstract:The electronic structure of VNi3 has been calculated and compared with the experimental results from photoemission, magnetic susceptibility and heat capacity measurements. The linearized muffintin orbitals method is used to compute the electronic density of states. Both paramagnetic and spin-polarized calculations have been performed and give results in good overall agreement with the experimental data.
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