Abstract We have already encountered several aspects of quantum theory: the presence of discrete energy levels in atoms; the exclusion principle which tells us how these levels are occupied; and the formation of energy bands in solids. We did not make a big deal of it at the time since, once we accepted the premise of the band gap in semiconductors, we were able to understand the operation of the transistor without worrying about whether we were using results of quantum theory. However, if we wish to probe further—to understand the devices of the future, those under development, and some which are already commercially available—then there is no escape. We have to confront quantum theory head on. We will not be concerned with any of the deep philosophical questions which arise from quantum theory. These are addressed in many other books, and do not concern us here. Instead, we will concentrate on the practical effects—how quantum theory affects the behaviour of semiconductor devices. From this point of view, there are two principal consequences, and we will devote a chapter to each. This chapter deals with wave-particle duality. If you have not encountered this phrase before, do not worry—all will be revealed in due course. The following chapter describes a phenomenon called tunnelling. It is only after exploring these concepts that it is possible to understand the operation of the quantum transistor, a subject which we turn to in Chapter 9.
Abstract We have already encountered several aspects of quantum theory: the presence of discrete energy levels in atoms; the exclusion principle which tells us how these levels are occupied; and the formation of energy bands in solids. We did not make a big deal of it at the time since, once we accepted the premise of the band gap in semiconductors, we were able to understand the operation of the transistor without worrying about whether we were using results of quantum theory. However, if we wish to probe further—to understand the devices of the future, those under development, and some which are already commercially available—then there is no escape. We have to confront quantum theory head on. We will not be concerned with any of the deep philosophical questions which arise from quantum theory. These are addressed in many other books, and do not concern us here. Instead, we will concentrate on the practical effects—how quantum theory affects the behaviour of semiconductor devices. From this point of view, there are two principal consequences, and we will devote a chapter to each. This chapter deals with wave-particle duality. If you have not encountered this phrase before, do not worry—all will be revealed in due course. The following chapter describes a phenomenon called tunnelling. It is only after exploring these concepts that it is possible to understand the operation of the quantum transistor, a subject which we turn to in Chapter 9.
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 identity and size of atoms is explicable only in quantum physics. The double slit experiment illustrates the wave-particle duality of light and of matter. To describe quantum interference the concept of a complex probability is introduced, the squared amplitude of which is the probability of a particle being at a particular location. The uncertainty relation requires atomic motion in solids even at absolute zero. The symmetry of exchanging indistinguishable particles leads to the classification of particles as fermions or bosons. The exclusion principle applies to electrons and rationalises the Periodic Table and much more. Electrons in solids exist in bands of energy. Band theory explains why some materials are electrical conductors, others are insulators or semiconductors. Chemical bonding involves quantum tunnelling of electrons. Hydrogen may diffuse in solids by quantum tunnelling. The temperature dependence of the specific heat of a solid is explicable only in quantum physics.
Chapter 4 deals with Quantum Mechanical (QM) phenomena. The first section describes the first attempts at quantization of energy, momentum, angular momentum, etc. We start with Plank's solution to the black-body problem, introducing the concept of photons: discrete packets of electromagnetic energy. We show how Plank's description of black-body radiation is perfectly fit by the cosmic microwave radiation, providing the strongest evidence for the Big-Bang at the origin of the Universe. We then describe Bohr's solution to the paradoxical stability of atoms, introducing quantization of angular momentum (or action) and correctly predicting the energy levels of the hydrogen atom. We show how Einstein used Plank's idea to explain the photo-electric effect (an effect exploited in CCD cameras and solar cells) and how he used Bohr's understanding of energy levels in atoms to provide an intuitive explanation of Plank's law. Einstein insight opened the way to the field of spectroscopy and the development of the laser. In the second section, following the lead of Dirac, we show that QM is equivalent to Linear Algebra in the space of complex functions (which describe the state of the system). We show that Schrödinger's equation is a natural consequence of that description, once the relation between energy and frequency established by Plank (for photons) and de Broglie (for particles) is taken into account. In the context of the chiral ammonia molecule we discuss the queerness of QM which describes physical systems as superposition of states (such as left and right chirality state of a molecule, dead and alive cat). We show that this queerness is nonetheless supported by experiments and is behind much of our technology: masers and lasers, atomic clocks, semiconductors (diodes, transistors, etc.). In the following section we introduce the representation of operators in QM (the equivalent of matrices in linear algebra): momentum, position, energy, etc. which correspond to measurements on the system. We show that the non-commutability of some operators (common with matrix operations) leads to Heisenberg uncertainty principle: the position and momentum of a particle cannot be determined with absolute precision. We discuss the solution of Schrödinger's equation for free particles demonstrating their equivalence with EM phenomena: particles undergo refraction and diffraction, exemplifying the particle/wave duality inherent to QM systems. We discuss QM tunneling and its use in the Scanning Tunneling Microscope. In the following section we study Dirac's equation: the successful attempt by Dirac to unify QM with Einstein's relativity, with the resulting prediction of anti-particles and spin. We then solve for the energy levels of electrons in the hydrogen atom (from Schrödinger's equation) and show that the existence of spin profoundly affects the behavior of electrons in an atom: they cannot share the same energy level, a rule known as Pauli's exclusion principle. Pauli's principle is central to the understanding of the chemical properties of atoms and fully explains Mendeleev's periodic table of the elements. In the next section we discuss along with two exactly soluble systems (diatomic rotational and vibrational levels), various approximations used to study systems (e.g. molecules) for which there are no analytical solutions. In particular, we introduce Pauling's variational approach, Hückel molecular orbital theory and time independent perturbation theory. We apply those approaches to determine the energy levels in alkenes, in multi-electron atoms and in systems under constant electric or magnetic field (such as in Magnetic Resonance Imaging). In the last section we discuss time dependent perturbation theory. We use it to establish the rules allowing for transitions between energy levels and revisit Einstein description of absorption/emission phenomena.
Chapter 2 begins with a discussion of the de Broglie wave concept that is the foundation of quantum mechanics. The idea that particles can exhibit wave-like behavior is an important part of the explanation of why atoms have discrete energy levels and make transitions in which electromagnetic radiation is absorbed or emitted at specific frequencies. Important aspects of how quantum systems may be observed and how they develop in time are presented. The Schrödinger equation is introduced and the importance of the wavefunction covered. Mathematical simplifications that arise from considering symmetry are covered. Several examples of simple quantum systems are presented in which the calculation of electronic energy structure based on boundary conditions is illustrated. Sections on wave–particle duality and quantum observables are followed by others on the dynamics of two-level systems, mathematically complete representations of arbitrary states, and standard approaches for handling the temporal development of wavefunctions.
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.
1.1 Waves and particles in quantum mechanics In spite of the fact that the extraordinary progress of experimental techniques make us able to manipulate at will systems made of any small and well defined number of atoms, electrons and photons making therefore possible the actual performance of the gedankenexperimente that Einstein and Bohr had imagined to support their opposite views on the physical properties of the wavelike/particlelike objects (quantons) of the quantum world it does not seem that, after more than eighty years, a unanimous consensus has been reached in the physicist's community on how to understand their strange properties. Unfortunately, we cannot know whether Feynman would still insist in maintaining his famous sentence It is fair to say that nobody understands quantum mechanics. We can only discuss if, almost thirty years after his death, some progress towards this goal has been made. I believe that this is the case. I will show in fact that, by following the suggestions of Feynman himself, some clarification of the old puzzles can be achieved. This chapter therefore by no means is intended to provide an impartial review of the present status of the question but is focused on the exposure of the results of more than twenty years of research of my group in Rome, which in my opinion provide a possible way of connecting together at the same time the random nature of the events at the atomic level of reality and the completeness of their probabilistic representation by the principles of Quantum Mechanics.