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Quantity (common name/s) (Common) symbol/s Defining equation SI units Dimension Number of atoms N = Number of atoms remaining at time t. N 0 = Initial number of atoms at time t = 0
The first table of standard atomic weight was published by John Dalton (1766–1844) in 1805, based on a system in which the relative atomic mass of hydrogen was defined as 1. These relative atomic masses were based on the stoichiometric proportions of chemical reaction and compounds, a fact that greatly aided their acceptance: It was not ...
Atomic physics is the subfield of AMO that studies atoms as an isolated system of electrons and an atomic nucleus, while molecular physics is the study of the physical properties of molecules. The term atomic physics is often associated with nuclear power and nuclear bombs , due to the synonymous use of atomic and nuclear in standard English .
In quantum chemistry, the quantum theory of atoms in molecules (QTAIM), sometimes referred to as atoms in molecules (AIM), is a model of molecular and condensed matter electronic systems (such as crystals) in which the principal objects of molecular structure - atoms and bonds - are natural expressions of a system's observable electron density distribution function.
In practice, to determine a selection rule the integral itself does not need to be calculated: It is sufficient to determine the symmetry of the transition moment function . If the transition moment function is symmetric over all of the totally symmetric representation of the point group to which the atom or molecule belongs, then the integral ...
Hence, relative molecular masses could now be calculated from the masses of gas samples. Avogadro developed this hypothesis to reconcile Joseph Louis Gay-Lussac's 1808 law on volumes and combining gases with Dalton's 1803 atomic theory. The greatest difficulty Avogadro had to resolve was the huge confusion at that time regarding atoms and ...
In theoretical and computational chemistry, a basis set is a set of functions (called basis functions) that is used to represent the electronic wave function in the Hartree–Fock method or density-functional theory in order to turn the partial differential equations of the model into algebraic equations suitable for efficient implementation on a computer.
In quantum chemistry and molecular physics, the Born–Oppenheimer (BO) approximation is the best-known mathematical approximation in molecular dynamics. Specifically, it is the assumption that the wave functions of atomic nuclei and electrons in a molecule can be treated separately, based on the fact that the nuclei are much heavier than the electrons.