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Książki na temat „Electronic Structure - Functional Materials”

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Data publikacji: 7 września 2023

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1

Michael, Springborg, red. Density-functional methods in chemistry and materials science. Chichester: Wiley, 1997.

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2

Kakeshita, Tomoyuki. Progress in Advanced Structural and Functional Materials Design. Tokyo: Springer Japan, 2013.

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3

Electronic structure of materials. Oxford: Clarendon Press, 1993.

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4

Planes, Antoni, Lluís Mañosa i Avadh Saxena, red. Magnetism and Structure in Functional Materials. Berlin, Heidelberg: Springer Berlin Heidelberg, 2005. http://dx.doi.org/10.1007/3-540-31631-0.

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5

Planes, Antoni. Magnetism and structure in functional materials. Berlin [u.a.]: Springer, 2010.

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6

Sen, K. D. Statistical complexity: Applications in electronic structure. Dordrecht: Springer, 2011.

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7

1934-, Grasso Vincenzo, red. Electronic structure and electronic transitions in layered materials. Dordrecht, [Netherlands]: D. Reidel, 1986.

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8

Grasso, Vincenzo, red. Electronic Structure and Electronic Transitions in Layered Materials. Dordrecht: Springer Netherlands, 1986. http://dx.doi.org/10.1007/978-94-009-4542-5.

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9

Anisimov, Vladimir, i Yuri Izyumov. Electronic Structure of Strongly Correlated Materials. Berlin, Heidelberg: Springer Berlin Heidelberg, 2010. http://dx.doi.org/10.1007/978-3-642-04826-5.

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10

Goedecker, S. Low complexity algorithms for density functional electronic structure calculations. Ithaca, N.Y: Cornell Theory Center, Cornell University, 1993.

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11

C, Kang Z., red. Functional and smart materials: Structural evolution and structure analysis. New York: Plenum Press, 1998.

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12

Singh, David J., i Dimitrios A. Papaconstantopoulos, red. Electronic Structure and Magnetism of Complex Materials. Berlin, Heidelberg: Springer Berlin Heidelberg, 2003. http://dx.doi.org/10.1007/978-3-662-05310-2.

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13

name, No. Electronic structure and magnetism of complex materials. Berlin: Springer, 2003.

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14

1958-, Singh David J., i Papaconstantopoulos D. A, red. Electronic structure and magnetism of complex materials. Berlin: Springer, 2003.

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15

Wang, Z. L. Functional and Smart Materials: Structural Evolution and Structure Analysis. Boston, MA: Springer US, 1998.

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16

1936-, Chong Delano P., red. Recent advances in density functional methods. Singapore: World Scientific, 1995.

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17

Vincenzo, Barone, Bencini Alessandro 1951- i Fantucci Piercarlo, red. Recent advances in density functional methods. River Edge, N.J: World Scientific, 2002.

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18

K, Labanowski Jan, Andzelm J i Ohio Supercomputer Center Workshop on Theory and Applications of Density Functional Theory in Chemistry (1990 : Columbus, Ohio), red. Density functional methods in chemistry. New York: Springer-Verlag, 1991.

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19

Nanocrystalline ceramics: Synthesis and structure. Berlin: Springer, 2002.

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20

Alkauskas, Audrius. Advanced calculations for defects in materials: Electronic structure methods. Weinheim: Wiley-VCH, 2011.

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21

Vaclav, Vitek, i Srolovitz David J, red. Atomistic simulation of materials. New York: Plenum, 1989.

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22

1945-, Gonis Antonios, Turchi Patrice E. A, Kudrnovsky Josef, North Atlantic Treaty Organization. Scientific Affairs Division. i NATO Advanced Study Institute on Stability of Materials (1994 : Kerkyra, Greece), red. Stability of materials. New York: Plenum Press, 1996.

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23

M, Seminario J., red. Recent developments and applications of modern density functional theory. Amsterdam: Elsevier, 1996.

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24

Böhm, M. C. One-dimensional organometallic materials: An analysis of electronic structure effects. Berlin: Springer-Verlag, 1987.

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25

Isaacs, Eric Brice. Electronic structure and phase stability of strongly correlated electron materials. [New York, N.Y.?]: [publisher not identified], 2016.

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26

Goedecker, S. A critical assessment of the self-interaction corrected local density functional method and its algorithmic implementation. Ithaca, N.Y: Cornell Theory Center, Cornell University, 1996.

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27

Winterer, Markus. Nanocrystalline Ceramics: Synthesis and Structure. Berlin, Heidelberg: Springer Berlin Heidelberg, 2002.

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28

V, Vitek, Srolovitz David J i World Materials Congress (1988 : Chicago, Ill.), red. Atomistic simulation of materials: Beyond pair potentials. New York: Plenum Press, 1989.

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29

Labanowski, Jan K. Density Functional Methods in Chemistry. New York, NY: Springer New York, 1991.

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30

Guo, G. Electronic Structure Crystallography and Functional Motifs of Materials. Wiley & Sons, Limited, John, 2024.

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31

Computational Quantum Mechanics for Materials Engineers: The EMTO Method and Applications (Engineering Materials and Processes). Springer, 2007.

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32

Vitos, Levente. Computational Quantum Mechanics for Materials Engineers: The EMTO Method and Applications. Springer, 2010.

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33

Vitos, Levente. Computational Quantum Mechanics for Materials Engineers: The EMTO Method and Applications. Springer, 2007.

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34

Electronic Structure Methods For Complex Materials The Orthogonalized Linear Combination Of Atomic Orbitals. Oxford University Press, USA, 2012.

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35

Kakeshita, Tomoyuki. Progress in Advanced Structural and Functional Materials Design. Springer, 2014.

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36

Kakeshita, Tomoyuki. Progress in Advanced Structural and Functional Materials Design. Springer, 2012.

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37

Eriksson, Olle, Anders Bergman, Lars Bergqvist i Johan Hellsvik. Density Functional Theory. Oxford University Press, 2017. http://dx.doi.org/10.1093/oso/9780198788669.003.0001.

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Streszczenie:
Density functional theory (DFT) has established itself as a very capable platform for modelling from first principles electronic, optical, mechanical and structural properties of materials. Starting out from the Dirac equation for the many-body system of electrons and nuclei, an effective theory has been developed allowing for materials specific and parameter free simulations of non-magnetic and magnetic solid matter. In this Chapter an introduction will be given to DFT, the Hohenberg-Kohn theorems, the Kohn-Sham equation, and the formalism for how to deal with non-collinear magnetism.
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38

Parr, Robert G., i Yang Weitao. Density-Functional Theory of Atoms and Molecules. Oxford University Press, 1995. http://dx.doi.org/10.1093/oso/9780195092769.001.0001.

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This book is a rigorous, unified account of the fundamental principles of the density-functional theory of the electronic structure of matter and its applications to atoms and molecules. Containing a detailed discussion of the chemical potential and its derivatives, it provides an understanding of the concepts of electronegativity, hardness and softness, and chemical reactivity. Both the Hohenberg-Kohn-Sham and the Levy-Lieb derivations of the basic theorems are presented, and extensive references to the literature are included. Two introductory chapters and several appendices provide all the background material necessary beyond a knowledge of elementary quantum theory. The book is intended for physicists, chemists, and advanced students in chemistry.
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39

Rai, Dibya Prakash, red. Advanced Materials and Nano Systems: Theory and Experiment - Part 2. BENTHAM SCIENCE PUBLISHERS, 2022. http://dx.doi.org/10.2174/97898150499611220201.

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The discovery of new materials and the manipulation of their exotic properties for device fabrication is crucial for advancing technology. Nanoscience, and the creation of nanomaterials have taken materials science and electronics to new heights for the benefit of mankind. Advanced Materials and Nanosystems: Theory and Experiment covers several topics of nanoscience research. The compiled chapters aim to update students, teachers, and scientists by highlighting modern developments in materials science theory and experiments. The significant role of new materials in future technology is also demonstrated. The book serves as a reference for curriculum development in technical institutions and research programs in the field of physics, chemistry and applied areas of science like materials science, chemical engineering and electronics. This part covers 12 topics in these areas: 1. Recent advancements in nanotechnology: a human health Perspective 2. An exploratory study on characteristics of SWIRL of AlGaAs/GaAs in advanced bio based nanotechnological systems 3. Electronic structure of the half-Heusler ScAuSn, LuAuSn and their superlattice 4. Recent trends in nanosystems 5. Improvement of performance of single and multicrystalline silicon solar cell using low-temperature surface passivation layer and antireflection coating 6. Advanced materials and nanosystems 7. Effect of nanostructure-materials on optical properties of some rare earth ions doped in silica matrix 8. Nd2Fe14B and SmCO5: a permanent magnet for magnetic data storage and data transfer technology 9. Visible light induced photocatalytic activity of MWCNTS decorated sulfide based nano photocatalysts 10. Organic solar cells 11. Neodymium doped lithium borosilicate glasses 12. Comprehensive quantum mechanical study of structural features, reactivity, molecular properties and wave function-based characteristics of capmatinib
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40

Chezhina, Natalia, i Dmitry Korolev. Electronic Structure of Materials. Redaktorzy Natalia V. Chezhina i Dmitry A. Korolev. Jenny Stanford Publishing, 2019. http://dx.doi.org/10.1201/9780429242878.

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41

Prasad, Rajendra. Electronic Structure of Materials. CRC Press, 2013. http://dx.doi.org/10.1201/b15281.

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42

Electronic Structure of Materials. Taylor & Francis Group, 2013.

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43

Sutton, A. P. Electronic Structure of Materials. Oxford University Press, 1993.

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44

Prasad, Rajendra. Electronic Structure of Materials. Taylor & Francis Group, 2013.

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45

Prasad, Rajendra. Electronic Structure of Materials. Taylor & Francis Group, 2013.

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46

Prasad, Rajendra. Electronic Structure of Materials. Taylor & Francis Group, 2013.

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47

Prasad, Rajendra. Electronic Structure of Materials. Taylor & Francis Group, 2013.

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48

Sen, K. D. Statistical Complexity: Applications in Electronic Structure. Springer, 2014.

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49

Sen, K. D. Statistical Complexity: Applications in Electronic Structure. Springer, 2011.

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50

Li, Cheng Ming, Cheng Bao Jiang, Zhi Yong Zhong i Yi Chun Zhou. Functional and Electronic Materials, IUMRS-ICA2010. Trans Tech Publications, Limited, 2011.

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