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Relativistic Quantum Chemistry
Relativistic quantum chemistry combines relativistic mechanics with quantum chemistry to calculate elemental properties and structure, especially for the heavier elements of the periodic table. A prominent example is an explanation for the color of gold: due to relativistic effects, it is not silvery like most other metals. The term ''relativistic effects'' was developed in light of the history of quantum mechanics. Initially, quantum mechanics was developed without considering the theory of relativity. Relativistic effects are those discrepancies between values calculated by models that consider relativity and those that do not. Relativistic effects are important for heavier elements with high atomic numbers, such as lanthanides and actinides. Relativistic effects in chemistry can be considered to be perturbations, or small corrections, to the non-relativistic theory of chemistry, which is developed from the solutions of the Schrödinger equation. These corrections affect the el ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Relativistic Mechanics
In physics, relativistic mechanics refers to mechanics compatible with special relativity (SR) and general relativity (GR). It provides a non- quantum mechanical description of a system of particles, or of a fluid, in cases where the velocities of moving objects are comparable to the speed of light ''c''. As a result, classical mechanics is extended correctly to particles traveling at high velocities and energies, and provides a consistent inclusion of electromagnetism with the mechanics of particles. This was not possible in Galilean relativity, where it would be permitted for particles and light to travel at ''any'' speed, including faster than light. The foundations of relativistic mechanics are the postulates of special relativity and general relativity. The unification of SR with quantum mechanics is relativistic quantum mechanics, while attempts for that of GR is quantum gravity, an unsolved problem in physics. As with classical mechanics, the subject can be divided into ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Fine Structure
In atomic physics, the fine structure describes the splitting of the spectral lines of atoms due to electron spin and relativistic corrections to the non-relativistic Schrödinger equation. It was first measured precisely for the hydrogen atom by Albert A. Michelson and Edward W. Morley in 1887, laying the basis for the theoretical treatment by Arnold Sommerfeld, introducing the fine-structure constant. Background Gross structure The ''gross structure'' of line spectra is the structure predicted by the quantum mechanics of non-relativistic electrons with no spin. For a hydrogenic atom, the gross structure energy levels only depend on the principal quantum number ''n''. However, a more accurate model takes into account relativistic and spin effects, which break the degeneracy of the energy levels and split the spectral lines. The scale of the fine structure splitting relative to the gross structure energies is on the order of (''Zα'')2, where ''Z'' is the atomic number ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
1s Orbital
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 simpl ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Bohr Model
In atomic physics, the Bohr model or Rutherford–Bohr model was a model of the atom that incorporated some early quantum concepts. Developed from 1911 to 1918 by Niels Bohr and building on Ernest Rutherford's nuclear Rutherford model, model, it supplanted the plum pudding model of J. J. Thomson only to be replaced by the quantum atomic model in the 1920s. It consists of a small, dense nucleus surrounded by orbiting electrons. It is analogy, analogous to the structure of the Solar System, but with attraction provided by Coulomb's law, electrostatic force rather than gravity, and with the electron energies quantized (assuming only discrete values). In the history of atomic physics, it followed, and ultimately replaced, several earlier models, including Joseph Larmor's Solar System model (1897), Jean Perrin's model (1901), the Cubical atom, cubical model (1902), Hantaro Nagaoka's Saturnian model (1904), the plum pudding model (1904), Arthur Haas's quantum model (1910), the Ru ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Fine-structure Constant
In physics, the fine-structure constant, also known as the Sommerfeld constant, commonly denoted by (the Alpha, Greek letter ''alpha''), is a Dimensionless physical constant, fundamental physical constant that quantifies the strength of the electromagnetic interaction between elementary charged particles. It is a dimensionless quantity (dimensionless physical constant), independent of the system of units used, which is related to the strength of the coupling of an elementary charge ''e'' with the electromagnetic field, by the formula . Its numerical value is approximately , with a relative uncertainty of The constant was named by Arnold Sommerfeld, who introduced it in 1916 Equation 12a, ''"rund 7·" (about ...)'' when extending the Bohr model of the atom. quantified the gap in the fine structure of the spectral lines of the hydrogen atom, which had been measured precisely by Albert A. Michelson, Michelson and Edward W. Morley, Morley in 1887. Why the constant should have t ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Reduced Planck Constant
The Planck constant, or Planck's constant, denoted by h, is a fundamental physical constant of foundational importance in quantum mechanics: a photon's energy is equal to its frequency multiplied by the Planck constant, and the wavelength of a matter wave equals the Planck constant divided by the associated particle momentum. The constant was postulated by Max Planck in 1900 as a proportionality constant needed to explain experimental black-body radiation. Planck later referred to the constant as the "quantum of action". In 1905, Albert Einstein associated the "quantum" or minimal element of the energy to the electromagnetic wave itself. Max Planck received the 1918 Nobel Prize in Physics "in recognition of the services he rendered to the advancement of Physics by his discovery of energy quanta". In metrology, the Planck constant is used, together with other constants, to define the kilogram, the SI unit of mass. The SI units are defined in such a way that, when the Pla ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Bohr Radius
The Bohr radius () is a physical constant, approximately equal to the most probable distance between the nucleus and the electron in a hydrogen atom in its ground state. It is named after Niels Bohr, due to its role in the Bohr model of an atom. Its value is The number in parentheses denotes the uncertainty of the last digits. Definition and value The Bohr radius is defined as a_0 = \frac = \frac , where * \varepsilon_0 is the permittivity of free space, * \hbar is the reduced Planck constant, * m_ is the mass of an electron, * e is the elementary charge, * c is the speed of light in vacuum, and * \alpha is the fine-structure constant. The CODATA value of the Bohr radius (in SI units) is History In the Bohr model for atomic structure, put forward by Niels Bohr in 1913, electrons orbit a central nucleus under electrostatic attraction. The original derivation posited that electrons have orbital angular momentum in integer multiples of the reduced Planck ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Velocity
Velocity is a measurement of speed in a certain direction of motion. It is a fundamental concept in kinematics, the branch of classical mechanics that describes the motion of physical objects. Velocity is a vector (geometry), vector Physical quantity, quantity, meaning that both magnitude and direction are needed to define it. The Scalar (physics), scalar absolute value (Magnitude (mathematics), magnitude) of velocity is called , being a coherent derived unit whose quantity is measured in the International System of Units, SI (metric system) as metres per second (m/s or m⋅s−1). For example, "5 metres per second" is a scalar, whereas "5 metres per second east" is a vector. If there is a change in speed, direction or both, then the object is said to be undergoing an ''acceleration''. Definition Average velocity The average velocity of an object over a period of time is its Displacement (geometry), change in position, \Delta s, divided by the duration of the period, \Delt ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Electron Rest Mass
In particle physics, the electron mass (symbol: ) is the mass of a stationary electron, also known as the invariant mass of the electron. It is one of the fundamental constants of physics. It has a value of about or about , which has an energy-equivalent of about or about . Terminology The term "rest mass" is sometimes used because in special relativity the mass of an object can be said to increase in a frame of reference that is moving relative to that object (or if the object is moving in a given frame of reference). Most practical measurements are carried out on moving electrons. If the electron is moving at a relativistic velocity, any measurement must use the correct expression for mass. Such correction becomes substantial for electrons accelerated by voltages of over . For example, the relativistic expression for the total energy, , of an electron moving at speed is E = \gamma m_\mathrm c^2 , where * is the speed of light; * is the Lorentz factor, \gamma = 1/\sqr ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Electron
The electron (, or in nuclear reactions) is a subatomic particle with a negative one elementary charge, elementary electric charge. It is a fundamental particle that comprises the ordinary matter that makes up the universe, along with up quark, up and down quark, down quarks. Electrons are extremely lightweight particles that orbit the positively charged atomic nucleus, nucleus of atoms. Their negative charge is balanced by the positive charge of protons in the nucleus, giving atoms their overall electric charge#Charge neutrality, neutral charge. Ordinary matter is composed of atoms, each consisting of a positively charged nucleus surrounded by a number of orbiting electrons equal to the number of protons. The configuration and energy levels of these orbiting electrons determine the chemical properties of an atom. Electrons are bound to the nucleus to different degrees. The outermost or valence electron, valence electrons are the least tightly bound and are responsible for th ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Mass In Special Relativity
The word "mass" has two meanings in special relativity: ''invariant mass'' (also called rest mass) is an invariant quantity which is the same for all Observer (special relativity), observers in all reference frames, while the relativistic mass is dependent on the velocity of the observer. According to the concept of mass–energy equivalence, invariant mass is equivalent to ''rest energy'', while relativistic mass is equivalent to ''relativistic energy'' (also called total energy). The term "relativistic mass" tends not to be used in particle and nuclear physics and is often avoided by writers on special relativity, in favor of referring to the body's relativistic energy. In contrast, "invariant mass" is usually preferred over rest energy. The measurable inertia of a body in a given frame of reference is determined by its relativistic mass, not merely its invariant mass. For example, photons have zero rest mass but contribute to the inertia (and weight in a gravitational field) o ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
Lorentz Factor
The Lorentz factor or Lorentz term (also known as the gamma factor) is a dimensionless quantity expressing how much the measurements of time, length, and other physical properties change for an object while it moves. The expression appears in several equations in special relativity, and it arises in derivations of the Lorentz transformations. The name originates from its earlier appearance in Lorentz ether theory, Lorentzian electrodynamics – named after the Netherlands, Dutch physicist Hendrik Lorentz. It is generally denoted (the Greek lowercase letter gamma). Sometimes (especially in discussion of superluminal motion) the factor is written as (Greek uppercase-gamma) rather than . Definition The Lorentz factor is defined as \gamma = \frac = \frac = \frac , where: * is the relative velocity between inertial reference frames, * is the speed of light in vacuum, * is the ratio of to , * is coordinate time, * is the proper time for an observer (measuring time intervals in ... [...More Info...] [...Related Items...] OR: [Wikipedia] [Google] [Baidu] |
