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Bond energy (BE) is the average of all bond-dissociation energies of a single type of bond in a given molecule. [7] The bond-dissociation energies of several different bonds of the same type can vary even within a single molecule. For example, a water molecule is composed of two O–H bonds bonded as H–O–H. The bond energy for H 2 O is the ...
The term bond-dissociation energy is similar to the related notion of bond-dissociation enthalpy (or bond enthalpy), which is sometimes used interchangeably.However, some authors make the distinction that the bond-dissociation energy (D 0) refers to the enthalpy change at 0 K, while the term bond-dissociation enthalpy is used for the enthalpy change at 298 K (unambiguously denoted DH° 298).
A force field is the collection of parameters to describe the physical interactions between atoms or physical units (up to ~10 8) using a given energy expression. The term force field characterizes the collection of parameters for a given interatomic potential (energy function) and is often used within the computational chemistry community. [50]
Example Level Gravitational binding energy The gravitational binding energy of an object, such as a celestial body, is the energy required to expand the material to infinity. If a body with the mass and radius of Earth were made purely of hydrogen-1, then the gravitational binding energy of that body would be about 0.391658 eV per atom.
For example, for the bond of an electrical system, the flow is the current, while the effort is the voltage. By multiplying current and voltage in this example you can get the instantaneous power of the bond. A bond has two other features described briefly here, and discussed in more detail below. One is the "half-arrow" sign convention.
For a given cation, Pauling defined [2] the electrostatic bond strength to each coordinated anion as =, where z is the cation charge and ν is the cation coordination number. A stable ionic structure is arranged to preserve local electroneutrality , so that the sum of the strengths of the electrostatic bonds to an anion equals the charge on ...
Starting with Pauling in 1947 [12] a correlation between cation–anion bond length and bond strength was noted. It was shown later [13] that if bond lengths were included in the calculation of bond strength, its accuracy was improved, and this revised method of calculation was termed the bond valence. These new insights were developed by later ...
Carbon–fluorine bonds can have a bond dissociation energy (BDE) of up to 130 kcal/mol. [2] The BDE (strength of the bond) of C–F is higher than other carbon–halogen and carbon–hydrogen bonds. For example, the BDEs of the C–X bond within a CH 3 –X molecule is 115, 104.9, 83.7, 72.1, and 57.6 kcal/mol for X = fluorine, hydrogen ...