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Selection Rule
In physics and chemistry, a selection rule, or transition rule, formally constrains the possible transitions of a system from one quantum state to another. Selection rules have been derived for electromagnetic transitions in molecules, in atoms, in atomic nucleus, atomic nuclei, and so on. The selection rules may differ according to the technique used to observe the transition. The selection rule also plays a role in chemical reactions, where some are formally spin-forbidden reactions, that is, reactions where the spin state changes at least once from Reagent, reactants to Product (chemistry), products. In the following, mainly atomic and molecular transitions are considered. Overview In quantum mechanics the basis for a spectroscopic selection rule is the value of the ''transition moment integral'' :m_ = \int \psi_1^* \, \mu \, \psi_2 \, \mathrm\tau, where \psi_1 and \psi_2 are the wave functions of the two states, "state 1" and "state 2", involved in the transition, a ...
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Physics
Physics is the scientific study of matter, its Elementary particle, fundamental constituents, its motion and behavior through space and time, and the related entities of energy and force. "Physical science is that department of knowledge which relates to the order of nature, or, in other words, to the regular succession of events." It is one of the most fundamental scientific disciplines. "Physics is one of the most fundamental of the sciences. Scientists of all disciplines use the ideas of physics, including chemists who study the structure of molecules, paleontologists who try to reconstruct how dinosaurs walked, and climatologists who study how human activities affect the atmosphere and oceans. Physics is also the foundation of all engineering and technology. No engineer could design a flat-screen TV, an interplanetary spacecraft, or even a better mousetrap without first understanding the basic laws of physics. (...) You will come to see physics as a towering achievement of ...
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Point Group
In geometry, a point group is a group (mathematics), mathematical group of symmetry operations (isometry, isometries in a Euclidean space) that have a Fixed point (mathematics), fixed point in common. The Origin (mathematics), coordinate origin of the Euclidean space is conventionally taken to be a fixed point, and every point group in dimension ''d'' is then a subgroup of the orthogonal group O(''d''). Point groups are used to describe the Symmetry (geometry), symmetries of geometric figures and physical objects such as molecular symmetry, molecules. Each point group can be Group representation, represented as sets of orthogonal matrix, orthogonal matrices ''M'' that transform point ''x'' into point ''y'' according to . Each element of a point group is either a Rotation (mathematics), rotation (determinant of ), or it is a Reflection (mathematics), reflection or improper rotation (determinant of ). The geometric symmetries of crystals are described by space groups, which allow T ...
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Parity (physics)
In physics, a parity transformation (also called parity inversion) is the flip in the sign of ''one'' spatial coordinate. In three dimensions, it can also refer to the simultaneous flip in the sign of all three spatial coordinates (a point reflection): \mathbf: \beginx\\y\\z\end \mapsto \begin-x\\-y\\-z\end. It can also be thought of as a test for chirality of a physical phenomenon, in that a parity inversion transforms a phenomenon into its mirror image. All fundamental interactions of elementary particles, with the exception of the weak interaction, are symmetric under parity transformation. As established by the Wu experiment conducted at the US National Bureau of Standards by Chinese-American scientist Chien-Shiung Wu, the weak interaction is chiral and thus provides a means for probing chirality in physics. In her experiment, Wu took advantage of the controlling role of weak interactions in radioactive decay of atomic isotopes to establish the chirality of the weak f ...
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Spin (physics)
Spin is an Intrinsic and extrinsic properties, intrinsic form of angular momentum carried by elementary particles, and thus by List of particles#Composite particles, composite particles such as hadrons, atomic nucleus, atomic nuclei, and atoms. Spin is quantized, and accurate models for the interaction with spin require relativistic quantum mechanics or quantum field theory. The existence of electron spin angular momentum is inferred from experiments, such as the Stern–Gerlach experiment, in which silver atoms were observed to possess two possible discrete angular momenta despite having no orbital angular momentum. The relativistic spin–statistics theorem connects electron spin quantization to the Pauli exclusion principle: observations of exclusion imply half-integer spin, and observations of half-integer spin imply exclusion. Spin is described mathematically as a vector for some particles such as photons, and as a spinor or bispinor for other particles such as electrons. Sp ...
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Group (mathematics)
In mathematics, a group is a Set (mathematics), set with an Binary operation, operation that combines any two elements of the set to produce a third element within the same set and the following conditions must hold: the operation is Associative property, associative, it has an identity element, and every element of the set has an inverse element. For example, the integers with the addition, addition operation form a group. The concept of a group was elaborated for handling, in a unified way, many mathematical structures such as numbers, geometric shapes and polynomial roots. Because the concept of groups is ubiquitous in numerous areas both within and outside mathematics, some authors consider it as a central organizing principle of contemporary mathematics. In geometry, groups arise naturally in the study of symmetries and geometric transformations: The symmetries of an object form a group, called the symmetry group of the object, and the transformations of a given type form a ...
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Electric Dipole Transition
An electric dipole transition is the dominant effect of an interaction of an electron in an atom with the electromagnetic field. Following reference, consider an electron in an atom with quantum Hamiltonian H_0 , interacting with a plane electromagnetic wave : (,t)=E_0 \cos(ky-\omega t), \ \ \ (,t)=B_0 \cos(ky-\omega t). Write the Hamiltonian of the electron in this electromagnetic field as : H(t) \ = \ H_0 + W(t). Treating this system by means of time-dependent perturbation theory, one finds that the most likely transitions of the electron from one state to the other occur due to the summand of W(t) defined as : W_\mathrm(t) = \frac p_z \sin \omega t, \, where q and m_e are the charge and mass of a bare electron. Electric dipole transitions are the transitions between energy levels in the system with the Hamiltonian H_0 + W_\mathrm(t) . Between certain electron states the electric dipole transition rate may be zero due to one or more selection rules, particular ...
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Atomic Orbitals
In quantum mechanics, an atomic orbital () is a function describing the location and wave-like behavior of an electron in an atom. This function describes an electron's charge distribution around the atom's nucleus, and can be used to calculate the probability of finding an electron in a specific region around the nucleus. Each orbital in an atom is characterized by a set of values of three quantum numbers , , and , which respectively correspond to electron's energy, its orbital angular momentum, and its orbital angular momentum projected along a chosen axis ( magnetic quantum number). The orbitals with a well-defined magnetic quantum number are generally complex-valued. Real-valued orbitals can be formed as linear combinations of and orbitals, and are often labeled using associated harmonic polynomials (e.g., ''xy'', ) which describe their angular structure. An orbital can be occupied by a maximum of two electrons, each with its own projection of spin m_s. The simp ...
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Centrosymmetric
In crystallography, a centrosymmetric point group contains an inversion center as one of its symmetry elements. In such a point group, for every point (x, y, z) in the unit cell there is an indistinguishable point (-x, -y, -z). Such point groups are also said to have ''inversion'' symmetry. Point reflection is a similar term used in geometry. Crystals with an inversion center cannot display certain properties, such as the piezoelectric effect and the frequency doubling effect (second-harmonic generation). In addition, in such crystals, one-photon absorption (OPA) and two-photon absorption (TPA) processes are mutually exclusive, i.e., they do not occur simultaneously, and provide complementary information. The following space groups have inversion symmetry: the triclinic space group 2, the monoclinic 10-15, the orthorhombic 47-74, the tetragonal 83-88 and 123-142, the trigonal 147, 148 and 162-167, the hexagonal 175, 176 and 191-194, the cubic 200-206 and 221-230. Point g ...
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Laporte Rule
The Laporte rule is a rule that explains the intensities of absorption spectra for chemical species. It is a selection rule that rigorously applies to atoms, and to molecules that are centrosymmetric, i.e. with an inversion centre. It states that electronic transitions that conserve parity are forbidden. Thus transitions between two states that are each symmetric with respect to an inversion centre will not be observed. Transitions between states that are antisymmetric with respect to inversion are forbidden as well. In the language of symmetry, ''g'' (gerade = even (German)) → ''g'' and ''u'' (ungerade = odd) → ''u'' transitions are forbidden. Allowed transitions must involve a change in parity, either ''g'' → ''u'' or ''u'' → ''g''. For atoms s and d orbitals are gerade, and p and f orbitals are ungerade. The Laporte rule implies that s to s, p to p, d to d, etc. transitions should not be observed in atoms or centrosymmetric molecules. Practically speaking, only d-d t ...
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Cambridge University Press
Cambridge University Press was the university press of the University of Cambridge. Granted a letters patent by King Henry VIII in 1534, it was the oldest university press in the world. Cambridge University Press merged with Cambridge Assessment to form Cambridge University Press and Assessment under Queen Elizabeth II's approval in August 2021. With a global sales presence, publishing hubs, and offices in more than 40 countries, it published over 50,000 titles by authors from over 100 countries. Its publications include more than 420 academic journals, monographs, reference works, school and university textbooks, and English language teaching and learning publications. It also published Bibles, runs a bookshop in Cambridge, sells through Amazon, and has a conference venues business in Cambridge at the Pitt Building and the Sir Geoffrey Cass Sports and Social Centre. It also served as the King's Printer. Cambridge University Press, as part of the University of Cambridge, was a ...
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Character Tables
In group theory, a branch of abstract algebra, a character table is a two-dimensional table whose rows correspond to irreducible representations, and whose columns correspond to conjugacy classes of group elements. The entries consist of characters, the traces of the matrices representing group elements of the column's class in the given row's group representation. In chemistry, crystallography, and spectroscopy, character tables of point groups are used to classify ''e.g.'' molecular vibrations according to their symmetry, and to predict whether a transition between two states is forbidden for symmetry reasons. Many university level textbooks on physical chemistry, quantum chemistry, spectroscopy and inorganic chemistry devote a chapter to the use of symmetry group character tables. Definition and example The irreducible complex characters of a finite group form a character table which encodes much useful information about the group ''G'' in a concise form. Each row is labe ...
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Even And Odd Functions
In mathematics, an even function is a real function such that f(-x)=f(x) for every x in its domain. Similarly, an odd function is a function such that f(-x)=-f(x) for every x in its domain. They are named for the parity of the powers of the power functions which satisfy each condition: the function f(x) = x^n is even if ''n'' is an even integer, and it is odd if ''n'' is an odd integer. Even functions are those real functions whose graph is self-symmetric with respect to the and odd functions are those whose graph is self-symmetric with respect to the origin. If the domain of a real function is self-symmetric with respect to the origin, then the function can be uniquely decomposed as the sum of an even function and an odd function. Early history The concept of even and odd functions appears to date back to the early 18th century, with Leonard Euler playing a significant role in their formalization. Euler introduced the concepts of even and odd functions (using La ...
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