Quantum mechanics began in very early twentieth century when Max Planck found the expression for black body thermal radiation in which the emitted light was not a continuum as postulated by classical physics. Erwin Schrodinger applied his equation to solve the quantum harmonic oscillator, the quantum rigid rotor, and a hydrogen-like atom. Pertaining to the solution of the Schrodinger equation to hydrogen atoms are the quantum numbers. C. K. Ingold’s overview of Schrodinger wave mechanics: “What can be known about an electron, considered as a particle, is of a statistical nature, and is summarized in the behavior of a wave. When considering singlet substances, the normal Zeeman Effect occurs, providing the discrete values of the orbital angular momentum. In an attempt to rationalize the anomalous Zeeman effect, W. Pauli proposed the fourth degree of freedom of the electron which he called “two-valuedness not describable classically”.
Quantum mechanics began in very early twentieth century when Max Planck found the expression for black body thermal radiation in which the emitted light was not a continuum as postulated by classical physics. Erwin Schrodinger applied his equation to solve the quantum harmonic oscillator, the quantum rigid rotor, and a hydrogen-like atom. Pertaining to the solution of the Schrodinger equation to hydrogen atoms are the quantum numbers. C. K. Ingold’s overview of Schrodinger wave mechanics: “What can be known about an electron, considered as a particle, is of a statistical nature, and is summarized in the behavior of a wave. When considering singlet substances, the normal Zeeman Effect occurs, providing the discrete values of the orbital angular momentum. In an attempt to rationalize the anomalous Zeeman effect, W. Pauli proposed the fourth degree of freedom of the electron which he called “two-valuedness not describable classically”.
Toward the end of the nineteenth century, it became clear that some experiments cannot be explained on the basis of known physics, now referred to as classical physics. In 1900, Max Planck was able to correctly describe the distribution of blackbody radiation energy as a function of wavelength λ or frequency ν = c/λ. He had to accept the existence of energy packets (quanta) with energy E = hν. A few years later, Albert Einstein found that this unexpected relation between energy and frequency is also necessary in order to understand photoemission from metallic surfaces. A decade later, Niels Bohr arrived at the correct equation for the electronic spectrum of the hydrogen atom by applying “quantum conditions” on the motion of the electron around the nucleus and the Planck’s relation E = hν on the energy difference between the energy levels (1916). A decade later, Heisenberg, Born, and Jordan introduced “quantum mechanics” and de Broglie and Schrödinger (1925-1926) introduced “wave mechanics.”
Quantum mechanics deals with the behaviour of matter and light on the atomic and subatomic scale. It attempts to describe and account for the properties of molecules and atoms and their constituents--electrons, protons, neutrons, and other more esoteric particles such as quarks and gluons. Its concepts frequently conflict with common-sense notions derived from observations of the everyday world. Quantum mechanics has attracted some of the ablest scientists of the 20th century, and they have erected what is perhaps the finest intellectual edifice of the period. Quantum mechanics is concerned with phenomena that are so small-scale that they cannot be described in classical terms. The history of quantum mechanics may be divided into three main periods. The first began with Planck's theory of black-body radiation in 1900; it may be described as the period in which the validity of Planck's constant was demonstrated but its real meaning was not fully understood. The second period began with the quantum theory of atomic structure and spectra proposed by Niels Bohr in 1913. True quantum mechanics appeared in 1926, reaching fruition nearly simultaneously in a variety of forms--namely, the matrix theory of Max Born and Werner Heisenberg, the wave mechanics of Louis V. de Broglie and Erwin Schrodinger, and the transformation theory of P.A.M. Dirac and Pascual Jordan.
At the beginning of the twentieth century, it became clear that microscopic particles do not obey Newton's laws of classical mechanics. The idea of light quanta was at odds with the established wisdom that light is a wave phenomenon, of course, but no other explanation of the photoelectric effect seemed possible. The next step in the development of quantum mechanics was taken by Niels Bohr, who introduced postulates about the discreteness of the energy of the bound electrons in an atom similar to the discreteness of the energy of light quanta. Modern quantum mechanics was founded by Werner Heisenberg, Max Born, Erwin Schroedinger, Paul Adrian Maurice Dirac, Wolfgang Pauli, Enrico Fermi, and others. In quantum mechanics, it is in general fundamentally impossible to determine the exact outcome of an experiment; one can only determine the probability of any given outcome.
During 1925 three different but equivalent versions of quantum theory were proposed, Schrodinger proposed wave mechanics; Heisenberg developed matrix mechanics and Dirac-introduced operator theory. Considering the de Broglie's matter waves Erwin Schrödinger, an Austrian physicist, argued that if a particle like an electron behaves as a wave then the equation of wave motion could be successfully applied to it. He postulated a function varying in both space and time in a wave-like manner. Schrodinger set up a linear and time-dependent wave-like equation, called Schrodinger wave equation, to describe the wave aspect of a particle taking account of de Broglie's relation for wavelength. This chapter discusses the Schrodinger equation and explores the general properties of the solution of the Schrodinger equation. It verifies the Ehrenfest's theorem in certain interesting systems and solves equation for linear harmonic oscillator and shows that their solutions are identical to the solutions of classical equation of motion.
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.
Quantum Mechanics and its Interpretations Peter E. Hodgson (bio) Quantum Mechanics is an elegant and indeed beautiful formalism, and enables the results of many physical measurements to be calculated with great accuracy. But from the earliest days there has been intense debate about the interpretation of quantum mechanics, and it shows no signs of being settled; if anything, it is becoming more intense over the years. It should therefore be evident that the most that can be done here is to try to show where the real difficul-ties lie, and how the failure to recognize that quantum mechanics is an essentially statistical theory has led to a series of confusing quantum paradoxes. It is just these paradoxes that have often been used to support theological speculations. The Discovery of the Quantum The quantum nature of the physical world was discovered by Max Planck in the early years of the twentieth century. He was studying thermodynamics and his attention was drawn to the frequency distribution of black-body radiation. This radiation is emitted from a small hole in a heated enclosure with rough walls, which ensures [End Page 62] that the radiation reaches statistical equilibrium before emission. The frequency distribution is found to be independent of the material lining the walls of the oven, so Planck realized that it must be a fundamental characteristic of all matter. This frequency distribution had been measured by several experimentalists, and Planck resolved to try to see how it can be derived theoretically. Already Rayleigh and Jeans had used classical radiation theory to derive an expression that fitted the data well at low frequencies but tended to infinity at high energies, which was of course unacceptable. The physicist Wien had derived a formula that fitted the data at high frequencies but failed at low frequencies. Planck used an ingenious argument based on entropy to interpolate between these two formulae and obtained a formula, now known as the Planck distribution, that fitted the data perfectly. His next task was to understand the physics behind his formula. He used the familiar technique of assuming that the energy is emitted in small finite amounts, and then let their size tend to zero, so as to represent a continuous distribution. To his great surprise, the intermediate formula with discrete amounts of energy, called quanta, gave the Planck distribution, but the final result, with infinitely small quanta, did not. All his instincts as a physicist rebelled against this conclusion. Surely energy must be emitted continuously. He tried hard to find a way to avoid this unwelcome conclusion, but without success. He had to admit that it is a feature of the world. Soon it was confirmed by Einstein’s interpretation of the photoelectric effect. This story shows clearly that physicists do not impose their ideas on the world, but recognize and accept what they find, whether or not it agrees with their original ideas. The world is made by God in ways that often we cannot imagine. [End Page 63] The Old Quantum Theory A few years later Rutherford discovered that the atom has a small central nucleus containing most of its mass surrounded by a number of electrons. Bohr used the idea of the quantum to build his model of the atom. He assumed that the electrons go around the nucleus in discrete orbits, and that radiation is emitted when an electron falls from one orbit to a lower one. With this model, he was able to calculate to high accuracy the frequencies of the radiation emitted from an excited hydrogen atom. This was a great achievement, but to get his result he had to assume that the electrons stayed in their orbits, whereas classical theory predicted that they would continuously lose energy and rapidly spiral into the nucleus. Quantum Mechanics and its Interpretations These problems were solved by the development of quantum mechanics in the 1920s by Heisenberg, Schrodinger, Dirac, and others. This enabled what is called the wave function to be calculated for any physical system, and from the wave function the probabilities of occurrence of measurable quantities can be found. It is a beautiful theory, and is the indispensable means of calculation for atomic, nuclear...