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Radius of gyration

From Wikipedia, the free encyclopedia
Distance from center of mass to axis of rotation
"Gyradius" redirects here. For the concept in physics, seeGyroradius.

Theradius of gyration orgyradius of a body about theaxis of rotation is defined as theradial distance to a point which would have amoment of inertia the same as the body's actual distribution ofmass, if the total mass of the body were concentrated there. The radius of gyration hasdimensions ofdistance [L] and is described by theSI unitmetre.

Formulation

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Mathematically theradius ofgyration is theroot mean square distance of the object's parts from either itscenter of mass or a given axis, depending on the relevant application. It is actually the perpendicular distance from point mass to the axis of rotation. One can represent a trajectory of a moving point as a body. Then radius of gyration can be used to characterize the typical distance travelled by this point.

Suppose a body consists ofn{\displaystyle n} particles each of massm{\displaystyle m}. Letr1,r2,r3,,rn{\displaystyle r_{1},r_{2},r_{3},\dots ,r_{n}} be their perpendicular distances from the axis of rotation. Then, the moment of inertiaI{\displaystyle I} of the body about the axis of rotation is

I=m1r12+m2r22++mnrn2{\displaystyle I=m_{1}r_{1}^{2}+m_{2}r_{2}^{2}+\cdots +m_{n}r_{n}^{2}}

If all the masses are the same (m{\displaystyle m}), then the moment of inertia isI=m(r12+r22++rn2){\displaystyle I=m(r_{1}^{2}+r_{2}^{2}+\cdots +r_{n}^{2})}.

Sincem=M/n{\displaystyle m=M/n} (M{\displaystyle M} being the total mass of the body),

I=M(r12+r22++rn2)/n{\displaystyle I=M(r_{1}^{2}+r_{2}^{2}+\cdots +r_{n}^{2})/n}

From the above equations, we have

MRg2=M(r12+r22++rn2)/n{\displaystyle MR_{g}^{2}=M(r_{1}^{2}+r_{2}^{2}+\cdots +r_{n}^{2})/n}

Radius of gyration is the root mean square distance of particles from axis formula

Rg2=(r12+r22++rn2)/n{\displaystyle R_{g}^{2}=(r_{1}^{2}+r_{2}^{2}+\cdots +r_{n}^{2})/n}

Therefore, the radius of gyration of a body about a given axis may also be defined as the root mean square distance of the various particles of the body from the axis of rotation. It is also known as a measure of the way in which the mass of a rotatingrigid body is distributed about its axis of rotation.

Applications in structural engineering

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Instructural engineering, the two-dimensional radius of gyration is used to describe the distribution ofcross sectional area in a column around itscentroidal axis with the mass of the body. The radius of gyration is given by the following formula:

Rg=IA{\displaystyle R_{\mathrm {g} }={\sqrt {\frac {I}{A}}}}

WhereI{\displaystyle I} is thesecond moment of area andA{\displaystyle A} is the total cross-sectional area.

The gyration radius is useful in estimating the stiffness of a column. If the principal moments of the two-dimensionalgyration tensor are not equal, the column will tend tobuckle around the axis with the smaller principal moment. For example, a column with anelliptical cross-section will tend to buckle in the direction of the smaller semiaxis.

Inengineering, where continuous bodies of matter are generally the objects of study, the radius of gyration is usually calculated as an integral.

Applications in mechanics

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The radius of gyration about a given axis (rg axis{\displaystyle r_{\mathrm {g} {\text{ axis}}}}) can be calculated in terms of themass moment of inertiaIaxis{\displaystyle I_{\text{axis}}} around that axis, and the total massm;

rg axis=Iaxism{\displaystyle r_{\mathrm {g} {\text{ axis}}}={\sqrt {\frac {I_{\text{axis}}}{m}}}}

Iaxis{\displaystyle I_{\text{axis}}} is ascalar, and is not the moment of inertiatensor.[1]

Molecular applications

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IUPAP definition

Radius of gyration (in polymer science)(s{\displaystyle s}, unit: nm or SI unit: m): For a macromolecule composed ofn{\displaystyle n} mass elements, of massesmi{\displaystyle m_{i}},i{\displaystyle i}=1,2,…,n{\displaystyle n}, located at fixed distancessi{\displaystyle s_{i}} from the centre of mass, the radius of gyration is the square-root of the mass average ofsi2{\displaystyle s_{i}^{2}} over all mass elements, i.e.,

s=(i=1nmisi2/i=1nmi)1/2{\displaystyle s=\left(\sum _{i=1}^{n}m_{i}s_{i}^{2}/\sum _{i=1}^{n}m_{i}\right)^{1/2}}

Note: The mass elements are usually taken as the masses of the skeletal groups constituting the macromolecule, e.g., –CH2– in poly(methylene).[2]

IUPAC definition for radius of gyration

Inpolymer physics, the radius of gyration is used to describe the dimensions of apolymerchain. The radius of gyration of an individual homopolymer withdegree of polymerization N at a given time is defined as:[3]

Rg2 =def 1Nk=1N|rkrmean|2{\displaystyle R_{\mathrm {g} }^{2}\ {\stackrel {\mathrm {def} }{=}}\ {\frac {1}{N}}\sum _{k=1}^{N}\left|\mathbf {r} _{k}-\mathbf {r} _{\mathrm {mean} }\right|^{2}}

wherermean{\displaystyle \mathbf {r} _{\mathrm {mean} }} is themean position of the monomers.As detailed below, the radius of gyration is also proportional to the root mean square distance between the monomers:

Rg2 =def 12N2ij|rirj|2{\displaystyle R_{\mathrm {g} }^{2}\ {\stackrel {\mathrm {def} }{=}}\ {\frac {1}{2N^{2}}}\sum _{i\neq j}\left|\mathbf {r} _{i}-\mathbf {r} _{j}\right|^{2}}

As a third method, the radius of gyration can also be computed by summing the principal moments of thegyration tensor.

Since the chainconformations of a polymer sample are quasi infinite in number and constantly change over time, the "radius of gyration" discussed in polymer physics must usually be understood as a mean over all polymer molecules of the sample and over time. That is, the radius of gyration which is measured as anaverage over time orensemble:

Rg2 =def 1Nk=1N|rkrmean|2{\displaystyle R_{\mathrm {g} }^{2}\ {\stackrel {\mathrm {def} }{=}}\ {\frac {1}{N}}\left\langle \sum _{k=1}^{N}\left|\mathbf {r} _{k}-\mathbf {r} _{\mathrm {mean} }\right|^{2}\right\rangle }

where the angular brackets{\displaystyle \langle \ldots \rangle } denote theensemble average.

An entropically governed polymer chain (i.e. in so called theta conditions) follows arandom walk in three dimensions. The radius of gyration for this case is given by

Rg=16  N a{\displaystyle R_{\mathrm {g} }={\frac {1}{{\sqrt {6}}\ }}\ {\sqrt {N}}\ a}

Note that althoughaN{\displaystyle aN} represents thecontour length of the polymer,a{\displaystyle a} is strongly dependent of polymer stiffness and can vary over orders of magnitude.N{\displaystyle N} is reduced accordingly.

One reason that the radius of gyration is an interesting property is that it can be determined experimentally withstatic light scattering as well as withsmall angle neutron- andx-ray scattering. This allows theoretical polymer physicists to check their models against reality.Thehydrodynamic radius is numerically similar, and can be measured withDynamic Light Scattering (DLS).

Derivation of identity

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To show that the two definitions ofRg2{\displaystyle R_{\mathrm {g} }^{2}} are identical, we first multiply out the summand in the first definition:

Rg2 =def 1Nk=1N(rkrmean)2=1Nk=1N[rkrk+rmeanrmean2rkrmean]{\displaystyle R_{\mathrm {g} }^{2}\ {\stackrel {\mathrm {def} }{=}}\ {\frac {1}{N}}\sum _{k=1}^{N}\left(\mathbf {r} _{k}-\mathbf {r} _{\mathrm {mean} }\right)^{2}={\frac {1}{N}}\sum _{k=1}^{N}\left[\mathbf {r} _{k}\cdot \mathbf {r} _{k}+\mathbf {r} _{\mathrm {mean} }\cdot \mathbf {r} _{\mathrm {mean} }-2\mathbf {r} _{k}\cdot \mathbf {r} _{\mathrm {mean} }\right]}

Carrying out the summation over the last two terms and using the definition ofrmean{\displaystyle \mathbf {r} _{\mathrm {mean} }} gives the formula

Rg2 =def rmeanrmean+1Nk=1N(rkrk){\displaystyle R_{\mathrm {g} }^{2}\ {\stackrel {\mathrm {def} }{=}}\ -\mathbf {r} _{\mathrm {mean} }\cdot \mathbf {r} _{\mathrm {mean} }+{\frac {1}{N}}\sum _{k=1}^{N}\left(\mathbf {r} _{k}\cdot \mathbf {r} _{k}\right)}

On the other hand, the second definition can be calculated in the same way as follows.

Rg2 =def 12N2i,j|rirj|2=12N2i,j(riri2rirj+rjrj)=12N2[Ni(rirI)2i,j(rirj)+Nj(rjrj)]=1NkN(rkrk)1N2i,j(rirj)=1NkN(rkrk)rmeanrmean{\displaystyle {\begin{aligned}R_{\mathrm {g} }^{2}\ &{\stackrel {\mathrm {def} }{=}}\ {\frac {1}{2N^{2}}}\sum _{i,j}\left|\mathbf {r} _{i}-\mathbf {r} _{j}\right|^{2}\\&={\frac {1}{2N^{2}}}\sum _{i,j}\left(\mathbf {r} _{i}\cdot \mathbf {r} _{i}-2\mathbf {r} _{i}\cdot \mathbf {r} _{j}+\mathbf {r} _{j}\cdot \mathbf {r} _{j}\right)\\&={\frac {1}{2N^{2}}}\left[N\sum _{i}\left(\mathbf {r} _{i}\cdot \mathbf {r} _{I}\right)-2\sum _{i,j}\left(\mathbf {r} _{i}\cdot \mathbf {r} _{j}\right)+N\sum _{j}\left(\mathbf {r} _{j}\cdot \mathbf {r} _{j}\right)\right]\\&={\frac {1}{N}}\sum _{k}^{N}\left(\mathbf {r} _{k}\cdot \mathbf {r} _{k}\right)-{\frac {1}{N^{2}}}\sum _{i,j}\left(\mathbf {r} _{i}\cdot \mathbf {r} _{j}\right)\\&={\frac {1}{N}}\sum _{k}^{N}\left(\mathbf {r} _{k}\cdot \mathbf {r} _{k}\right)-\mathbf {r} _{\mathrm {mean} }\cdot \mathbf {r} _{\mathrm {mean} }\end{aligned}}}

Thus, the two definitions are the same.

The last transformation uses the relationship

1N2i,j(rirj)=1N2iri(jrj)=1Nirirmean=rmeanrmean.{\displaystyle {\begin{aligned}{\frac {1}{N^{2}}}\sum _{i,j}\left(\mathbf {r} _{i}\cdot \mathbf {r} _{j}\right)&={\frac {1}{N^{2}}}\sum _{i}\mathbf {r} _{i}\cdot \left(\sum _{j}\mathbf {r} _{j}\right)\\&={\frac {1}{N}}\sum _{i}\mathbf {r} _{i}\cdot \mathbf {r} _{\mathrm {mean} }\\&=\mathbf {r} _{\mathrm {mean} }\cdot \mathbf {r} _{\mathrm {mean} }.\end{aligned}}}

Applications in geographical data analysis

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In data analysis, the radius of gyration is used to calculate many different statistics including the spread of geographical locations. These locations have recently been collected from social media users to investigate the typical mentions of a user. This can be useful for understanding how a certain group of users on social media use the platform.

Rg=i=1Nmi(rirC)2i=1Nmi{\displaystyle R_{\mathrm {g} }={\sqrt {\frac {\sum _{i=1}^{N}m_{i}(r_{i}-r_{C})^{2}}{\sum _{i=1}^{N}m_{i}}}}}

Notes

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  1. ^See for exampleGoldstein, Herbert (1950),Classical Mechanics (1st ed.), Reading, Massachusetts: Addison-Wesley Publishing Company equation 5-30
  2. ^Stepto, R.; Chang, T.; Kratochvíl, P.; Hess, M.; Horie, K.; Sato, T.; Vohlídal, J. (2015)."Definitions of terms relating to individual macromolecules, macromolecular assemblies, polymer solutions, and amorphous bulk polymers (IUPAC Recommendations 2014)"(PDF).Pure Appl Chem.87 (1): 71.doi:10.1515/pac-2013-0201.
  3. ^Fixman, Marshall (1962). "Radius of Gyration of Polymer Chains".The Journal of Chemical Physics.36 (2):306–310.Bibcode:1962JChPh..36..306F.doi:10.1063/1.1732501.

References

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  • Grosberg AY and Khokhlov AR. (1994)Statistical Physics of Macromolecules (translated by Atanov YA), AIP Press.ISBN 1-56396-071-0
  • Flory PJ. (1953)Principles of Polymer Chemistry, Cornell University, pp. 428–429 (Appendix C of Chapter X).
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