Shielding effect

Last updated

In chemistry, the shielding effect sometimes referred to as atomic shielding or electron shielding describes the attraction between an electron and the nucleus in any atom with more than one electron. The shielding effect can be defined as a reduction in the effective nuclear charge on the electron cloud, due to a difference in the attraction forces on the electrons in the atom. It is a special case of electric-field screening. This effect also has some significance in many projects in material sciences.

Contents

Strength per electron shell

The wider the electron shells are in space, the weaker is the electric interaction between the electrons and the nucleus due to screening. In general we can order the electron shells (s,p,d,f) as such

where S is the screening strength that a given orbital provides to the rest of the electrons.

Description

In hydrogen, or any other atom in group 1A of the periodic table (those with only one valence electron), the force on the electron is just as large as the electromagnetic attraction from the nucleus of the atom. However, when more electrons are involved, each electron (in the nth-shell) experiences not only the electromagnetic attraction from the positive nucleus, but also repulsion forces from other electrons in shells from 1 to n. This causes the net force on electrons in outer shells to be significantly smaller in magnitude; therefore, these electrons are not as strongly bonded to the nucleus as electrons closer to the nucleus. This phenomenon is often referred to as the orbital penetration effect. The shielding theory also contributes to the explanation of why valence-shell electrons are more easily removed from the atom.

Additionally, there is also a shielding effect that occurs between sublevels within the same principal energy level. An electron in the s-sublevel is capable of shielding electrons in the p-sublevel of the same principal energy level.

The size of the shielding effect is difficult to calculate precisely due to effects from quantum mechanics. As an approximation, we can estimate the effective nuclear charge on each electron by the following:

Where Z is the number of protons in the nucleus and is the average number of electrons between the nucleus and the electron in question. can be found by using quantum chemistry and the Schrödinger equation, or by using Slater's empirical formulas.

In Rutherford backscattering spectroscopy, the correction due to electron screening modifies the Coulomb repulsion between the incident ion and the target nucleus at large distances. It is the repulsion effect caused by the inner electron on the outer electron.

See also

Related Research Articles

<span class="mw-page-title-main">Atomic orbital</span> Function describing an electron in an atom

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 the 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.

<span class="mw-page-title-main">Beta decay</span> Type of radioactive decay

In nuclear physics, beta decay (β-decay) is a type of radioactive decay in which an atomic nucleus emits a beta particle, transforming into an isobar of that nuclide. For example, beta decay of a neutron transforms it into a proton by the emission of an electron accompanied by an antineutrino; or, conversely a proton is converted into a neutron by the emission of a positron with a neutrino in so-called positron emission. Neither the beta particle nor its associated (anti-)neutrino exist within the nucleus prior to beta decay, but are created in the decay process. By this process, unstable atoms obtain a more stable ratio of protons to neutrons. The probability of a nuclide decaying due to beta and other forms of decay is determined by its nuclear binding energy. The binding energies of all existing nuclides form what is called the nuclear band or valley of stability. For either electron or positron emission to be energetically possible, the energy release or Q value must be positive.

<span class="mw-page-title-main">Bohr model</span> Atomic model introduced by Niels Bohr in 1913

In atomic physics, the Bohr model or Rutherford–Bohr model of the atom, presented by Niels Bohr and Ernest Rutherford in 1913, consists of a small, dense nucleus surrounded by orbiting electrons. It is analogous to the structure of the Solar System, but with attraction provided by electrostatic force rather than gravity, and with the electron energies quantized.

<span class="mw-page-title-main">Covalent bond</span> Chemical bond by sharing of electron pairs

A covalent bond is a chemical bond that involves the sharing of electrons to form electron pairs between atoms. These electron pairs are known as shared pairs or bonding pairs. The stable balance of attractive and repulsive forces between atoms, when they share electrons, is known as covalent bonding. For many molecules, the sharing of electrons allows each atom to attain the equivalent of a full valence shell, corresponding to a stable electronic configuration. In organic chemistry, covalent bonding is much more common than ionic bonding.

<span class="mw-page-title-main">Hydrogen atom</span> Atom of the element hydrogen

A hydrogen atom is an atom of the chemical element hydrogen. The electrically neutral atom contains a single positively charged proton and a single negatively charged electron bound to the nucleus by the Coulomb force. Atomic hydrogen constitutes about 75% of the baryonic mass of the universe.

<span class="mw-page-title-main">Proton</span> Subatomic particle with positive charge

A proton is a stable subatomic particle, symbol
p
, H+, or 1H+ with a positive electric charge of +1 e (elementary charge). Its mass is slightly less than the mass of a neutron and 1,836 times the mass of an electron (the proton-to-electron mass ratio). Protons and neutrons, each with masses of approximately one atomic mass unit, are jointly referred to as "nucleons" (particles present in atomic nuclei).

<span class="mw-page-title-main">Atomic radius</span> Measure of the size of an atom

The atomic radius of a chemical element is a measure of the size of its atom, usually the mean or typical distance from the center of the nucleus to the outermost isolated electron. Since the boundary is not a well-defined physical entity, there are various non-equivalent definitions of atomic radius. Four widely used definitions of atomic radius are: Van der Waals radius, ionic radius, metallic radius and covalent radius. Typically, because of the difficulty to isolate atoms in order to measure their radii separately, atomic radius is measured in a chemically bonded state; however theoretical calculations are simpler when considering atoms in isolation. The dependencies on environment, probe, and state lead to a multiplicity of definitions.

<span class="mw-page-title-main">Energy level</span> Different states of quantum systems

A quantum mechanical system or particle that is bound—that is, confined spatially—can only take on certain discrete values of energy, called energy levels. This contrasts with classical particles, which can have any amount of energy. The term is commonly used for the energy levels of the electrons in atoms, ions, or molecules, which are bound by the electric field of the nucleus, but can also refer to energy levels of nuclei or vibrational or rotational energy levels in molecules. The energy spectrum of a system with such discrete energy levels is said to be quantized.

<span class="mw-page-title-main">Ionization energy</span> Energy needed to remove an electron

In physics and chemistry, ionization energy (IE) (American English spelling), or ionisation energy (British English spelling) is the minimum energy required to remove the most loosely bound electron of an isolated gaseous atom, positive ion, or molecule. The first ionization energy is quantitatively expressed as

<span class="mw-page-title-main">Rydberg formula</span> Formula for spectral line wavelengths in alkali metals

In atomic physics, the Rydberg formula calculates the wavelengths of a spectral line in many chemical elements. The formula was primarily presented as a generalization of the Balmer series for all atomic electron transitions of hydrogen. It was first empirically stated in 1888 by the Swedish physicist Johannes Rydberg, then theoretically by Niels Bohr in 1913, who used a primitive form of quantum mechanics. The formula directly generalizes the equations used to calculate the wavelengths of the hydrogen spectral series.

In atomic physics, the effective nuclear charge is the actual amount of positive (nuclear) charge experienced by an electron in a multi-electron atom. The term "effective" is used because the shielding effect of negatively charged electrons prevent higher energy electrons from experiencing the full nuclear charge of the nucleus due to the repelling effect of inner layer. The effective nuclear charge experienced by an electron is also called the core charge. It is possible to determine the strength of the nuclear charge by the oxidation number of the atom. Most of the physical and chemical properties of the elements can be explained on the basis of electronic configuration. Consider the behavior of ionization energies in the periodic table. It is known that the magnitude of ionization potential depends upon the following factors:

  1. Size of atom;
  2. The nuclear charge;
  3. The screening effect of the inner shells, and
  4. The extent to which the outermost electron penetrates into the charge cloud set up by the inner lying electron.

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.

In atomic physics, the electron magnetic moment, or more specifically the electron magnetic dipole moment, is the magnetic moment of an electron resulting from its intrinsic properties of spin and electric charge. The value of the electron magnetic moment is −9.2847647043(28)×10−24 J⋅T−1. In units of the Bohr magneton (μB), it is −1.00115965218059(13) μB, a value that was measured with a relative accuracy of 1.3×10−13.

In quantum physics, the spin–orbit interaction is a relativistic interaction of a particle's spin with its motion inside a potential. A key example of this phenomenon is the spin–orbit interaction leading to shifts in an electron's atomic energy levels, due to electromagnetic interaction between the electron's magnetic dipole, its orbital motion, and the electrostatic field of the positively charged nucleus. This phenomenon is detectable as a splitting of spectral lines, which can be thought of as a Zeeman effect product of two relativistic effects: the apparent magnetic field seen from the electron perspective and the magnetic moment of the electron associated with its intrinsic spin. A similar effect, due to the relationship between angular momentum and the strong nuclear force, occurs for protons and neutrons moving inside the nucleus, leading to a shift in their energy levels in the nucleus shell model. In the field of spintronics, spin–orbit effects for electrons in semiconductors and other materials are explored for technological applications. The spin–orbit interaction is at the origin of magnetocrystalline anisotropy and the spin Hall effect.

The lanthanide contraction is the greater-than-expected decrease in atomic radii and ionic radii of the elements in the lanthanide series, from left to right. It is caused by the poor shielding effect of nuclear charge by the 4f electrons along with the expected periodic trend of increasing electronegativity and nuclear charge on moving from left to right. About 10% of the lanthanide contraction has been attributed to relativistic effects.

Core electrons are the electrons in an atom that are not valence electrons and do not participate in chemical bonding. The nucleus and the core electrons of an atom form the atomic core. Core electrons are tightly bound to the nucleus. Therefore, unlike valence electrons, core electrons play a secondary role in chemical bonding and reactions by screening the positive charge of the atomic nucleus from the valence electrons.

In quantum chemistry, Slater's rules provide numerical values for the effective nuclear charge in a many-electron atom. Each electron is said to experience less than the actual nuclear charge, because of shielding or screening by the other electrons. For each electron in an atom, Slater's rules provide a value for the screening constant, denoted by s, S, or σ, which relates the effective and actual nuclear charges as

<span class="mw-page-title-main">Electron localization function</span> Method of measuring the extent of spatial localization of an electron

In quantum chemistry, the electron localization function (ELF) is a measure of the likelihood of finding an electron in the neighborhood space of a reference electron located at a given point and with the same spin. Physically, this measures the extent of spatial localization of the reference electron and provides a method for the mapping of electron pair probability in multielectronic systems.

<span class="mw-page-title-main">Atomic nucleus</span> Core of an atom; composed of nucleons (protons and neutrons)

The atomic nucleus is the small, dense region consisting of protons and neutrons at the center of an atom, discovered in 1911 by Ernest Rutherford based on the 1909 Geiger–Marsden gold foil experiment. After the discovery of the neutron in 1932, models for a nucleus composed of protons and neutrons were quickly developed by Dmitri Ivanenko and Werner Heisenberg. An atom is composed of a positively charged nucleus, with a cloud of negatively charged electrons surrounding it, bound together by electrostatic force. Almost all of the mass of an atom is located in the nucleus, with a very small contribution from the electron cloud. Protons and neutrons are bound together to form a nucleus by the nuclear force.

<span class="mw-page-title-main">Helium atom</span> Atom of helium

A helium atom is an atom of the chemical element helium. Helium is composed of two electrons bound by the electromagnetic force to a nucleus containing two protons along with two neutrons, depending on the isotope, held together by the strong force. Unlike for hydrogen, a closed-form solution to the Schrödinger equation for the helium atom has not been found. However, various approximations, such as the Hartree–Fock method, can be used to estimate the ground state energy and wavefunction of the atom. Historically, the first such helium spectrum calculation was done by Albrecht Unsöld in 1927. Its success was considered to be one of the earliest signs of validity of Schrödinger's wave mechanics.

References