In order to understand the properties of nanoparticles, it is very much required to have knowledge of quantum mechanics. This chapter introduces the basic concept of quantum mechanics. This chapter starts with quantum theory for radiation. It has been observed that the phenomena related to intense radiation like interference, diffraction, etc., could be well described with the help of Maxwell’s wave theory. But in the case of weakly intensed light, wave theory cannot be used to predict the related experimental phenomena. In this regard, quantum theory has been developed considering the particle nature of radiation. This evaluation of quantum theory has been briefly discussed in this chapter. In the world of matter, Newton’s law is successfully used to predict the position, velocity, acceleration, etc., of any macroscopic particle. But this couldn’t be used for particles of tiny dimensions like electrons, neutrons, etc. The difference is that for macroscopic particles we can measure their position and velocity with some accuracy, but for tiny particles, called quantum particles, it is difficult to determine their position and velocity at any given point in time. Wave theory has been presented by Schrödinger to predict features of quantum particles. We have given a few examples where Schrödinger’s wave theory can successfully explain quantum particles’ behavior under static as well as dynamic conditions. But in a real system, we cannot use this theory. We have discussed a few approximation methods to be used with Schrödinger’s wave theory in the case of a real system.
In order to understand the properties of nanoparticles, it is very much required to have knowledge of quantum mechanics. This chapter introduces the basic concept of quantum mechanics. This chapter starts with quantum theory for radiation. It has been observed that the phenomena related to intense radiation like interference, diffraction, etc., could be well described with the help of Maxwell’s wave theory. But in the case of weakly intensed light, wave theory cannot be used to predict the related experimental phenomena. In this regard, quantum theory has been developed considering the particle nature of radiation. This evaluation of quantum theory has been briefly discussed in this chapter. In the world of matter, Newton’s law is successfully used to predict the position, velocity, acceleration, etc., of any macroscopic particle. But this couldn’t be used for particles of tiny dimensions like electrons, neutrons, etc. The difference is that for macroscopic particles we can measure their position and velocity with some accuracy, but for tiny particles, called quantum particles, it is difficult to determine their position and velocity at any given point in time. Wave theory has been presented by Schrödinger to predict features of quantum particles. We have given a few examples where Schrödinger’s wave theory can successfully explain quantum particles’ behavior under static as well as dynamic conditions. But in a real system, we cannot use this theory. We have discussed a few approximation methods to be used with Schrödinger’s wave theory in the case of a real system.
Quantum mechanics is a theory to explain and predict the behavior of particles such as electrons, protons, neutrons, atomic nuclei, atoms, and molecules, as well as the photon–the particle associated with electromagnetic radiation or light. From quantum theory we obtain the laws of chemistry as well as explanations for the properties of materials, such as crystals, semiconductors, superconductors, and superfluids. Applications of quantum behavior give us transistors, computer chips, lasers, and masers. The relatively new field of molecular biology, which leads to our better understanding of biological structures and life processes, derives from quantum considerations. Thus, quantum behavior encompasses a large fraction of modern science and technology. Quantum theory was developed during the first half of the twentieth century through the efforts of many scientists. In 1926, E. Schrödinger interjected wave mechanics into the array of ideas, equations, explanations, and theories that were prevalent at the time to explain the growing accumulation of observations of quantum phenomena. His theory introduced the wave function and the differential wave equation that it obeys. Schrödinger's wave mechanics is now the backbone of our current conceptional understanding and our mathematical procedures for the study of quantum phenomena. Our presentation of the basic principles of quantum mechanics is contained in the first three chapters. Chapter 1 begins with a treatment of plane waves and wave packets, which serves as background material for the subsequent discussion of the wave function for a free particle.
Quantum mechanics forms the basis of modern physics. In a sense it is the parent theory about which we construct our view of the physical world. Briefly, quantum mechanics is the theory by which we describe the behaviors of subatomic and atomic particles, such as electrons, of which the macroscopic world is made. Although it is not necessary to treat macroscopic objects by use of quantum mechanics, the laws of quantum mechanics and their implications are completely consistent with Newton's Laws of Motion, which we know are applicable to most macroscopic objects. As we will see below, Newton's Laws of Motion are a special subset of quantum mechanics; quantum mechanics reduces to Newton's Laws at macroscopic dimensions. Before we begin our study of quantum mechanics, it is of interest to explain why quantum mechanics is of importance in the study of modern electrical engineering. Many new areas of electrical engineering are based on developments that can be understood only through the use of quantum mechanics. Among these are the broad areas of semiconductors and solid-state electronic devices, electro-optics and lasers, superconductors. It would be fair to say that in the study of each of the above areas some knowledge of quantum mechanics is essential. In this book, some basic concepts in quantum mechanics are presented that are necessary in the study of the above-mentioned disciplines. Introduction The concept most basic toward the understanding of quantum mechanics is the concept of measurement.
One of the earliest and most important tenets of quantum mechanics is the wave-particle duality: light behaves sometimes like a wave and at other times as particle and similarly an electron can also behave both like a particle and as a wave. When the formal laws of quantum mechanics are formulated, the central quantity that describes the particles is the wave function. This points to the need for a good understanding of the properties of the waves. This chapter introduces the concepts and most essential applications that are required to follow the discussion of quantum mechanical laws and systems. The basic characteristics of the waves, such as the superposition principle are presented, and the interference and the diffraction phenomena are discussed. The Young’s double slit experiment in analysed and the formation of interference pattern is explicitly shown. The Rayleigh criterion for the microscopic resolution is also derived.
Classical mechanics, which gives a fairly accurate description of large systems (e.g., solar system) as also of mechanical systems in our every day life, however, breaks down when applied to small (microscopic) systems such as molecules, atoms and nuclei. For example, (1) classical mechanics cannot even explain why the atoms are stable at all. A classical atom with electrons moving in circular or elliptic orbits around the nucleus would continuously radiate energy in the form of electromagnetic radiation because an accelerated charge does radiate energy. As a result the radius of the orbit would become smaller and smaller, resulting in instability of the atom. On the other hand, the atoms are found to be remarkably stable in practice. (2) Another fact of observation that classical mechanics fails to explain is wave particle duality in radiation as well as in material particles. It is well known that light exhibits the phenomena of interference, diffraction and polarization which can be easily understood on the basis of wave aspect of radiation. But light also exhibits the phenomena of photo-electric effect, Compton effect and Raman effect which can only be understood in terms of corpuscular or quantum aspect of radiation. The dual behavior of light, or radiation cannot be consistently understood on the basis of classical concepts alone or explained away by saying that light behaves as wave or particle depending on the kind of experiment we do with it (complementarity). Moreover, a beam of material particles, like electrons and neutrons, demonstrates wave-like properties (e.g., diffraction). A brief outline of phenomena that require quantum mechanics for their understanding follows.
Chapter 3 provides a brief review of a few concepts from classical Newtonian physics, and how this fails to explain phenomena at the nanoscopic scale. As is detailed within, the classical mechanical model is able to describe all observed physical phenomena; however, when it comes to the nanoscale this model breaks down, because the properties of the materials change dramatically. At this scale, the surface-to-volume ratio increases, gravitational forces become negligible and random molecular motion becomes more important. This changes the properties of the material and affects the devices that are fabricated at this scale. It is hence necessary to develop a new model that can explain such physical phenomena. This has led to a new branch of physics, i.e. quantum physics (QP) or quantum mechanics, which is able to explain the behavior observed at nanoscale. QP enables us to explain phenomena such as the photoelectric effect, Compton effect. etc. In this chapter, we introduce quantum mechanics and how it evolved in the late 19th and early 20th centuries. Further, light’s behaviour as a particle as well as a wave is described by the photoelectric effect and Young’s double-slit experiment, respectively. Further, the dual nature of the particle is explained using the de Broglie principle. Schrodinger’s equation is then explained, which gives the probability of finding a subatomic-scale particle at a certain position in a quantum well. In addition to the formulation of Schrodinger’s equation, its solution, the concept of a potential well, the characteristics of the wave function and its interpretation and significance, and, finally, the application of Schrodinger’s equation in the structure of an atom form subsequent parts of this chapter. The equation serves as a basis with which to understand band theory. Band theory explains the difference between conductors, insulators and semiconductors. Materials are distinguished according to the differences in their band gaps. Adding impurities or varying temperature changes the band gap in semiconductors, which consequently changes the properties of the semiconductor and its electrical conduction. One more important measure to understand and exploit the properties and behaviour of materials is Fermi–Dirac statistics. It is useful to acquire the probability of electrons at a given energy level at a specific temperature. These concepts can be utilised by physicists and chip makers to make more energy-efficient devices. Hence, this chapter details the fundamentals of quantum physics and how they relate to the electrical properties of nanodevices.
The behavior of classical macroscopic particles – from baseballs to planets – is governed by Newtonian mechanics as we have described in the first chapters of this book. The behavior of very small particles, on the other hand, is governed by an entirely different collection of equations and rules that go under the name of “quantum mechanics” and these particles are referred to as quantum particles. These rules have analogies to classical mechanics, but are fundamentally different and somewhat mysterious as we discussed in Chapter 8. The fundamental principles of quantum mechanics cannot be proven to be correct. They were developed based on the results of experimental observation, by analogy with classical mechanics, and through the consideration of logical implications of the formalisms used. There is no way to derive the fundamental elements of quantum mechanics, any more than one could predict from first principles that Newtonian forces should add as vectors. On the other hand, quantum mechanics is among the most rigorously tested theories in science, and the predictions of quantum mechanics have, so far, always been in agreement with experiment. In this chapter, we will present quantum mechanics as a series of postulates and examine their implications in application to simple one-dimensional systems. In the next chapter we will examine quantum effects in real systems including atoms, molecules, crystals, and artificially engineered nano-structures. Postulates of quantum mechanics QM Postulate 1: A quantum particle is described by a wave function Ψ( x , y , z , t ) which is a function of spatial coordinates and time. All physically determinable quantities can be derived from the wave function Ψ( x , y , z , t ) ; quantities which cannot be found from the wave function are not physically meaningful. Note that some things that one could ask about a quantum particle, for example the exact position and simultaneous exact momentum of a particle, are not derivable from the wave function and are therefore considered indeterminate (or uncertain ). These are things which cannot ever be known about a particle, and, as such, they are meaningless to contemplate.