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Tectonophysics
journal homepage: www.elsevier.com/locate/tecto
Quantication of the spatial distribution of mineral phases and grains in rock using a
2-D multiple-area density map technique
Sungshil Kim, Jin-Han Ree
Department of Earth and Environmental Sciences, Korea University, Seoul 136-701, South Korea
a r t i c l e
i n f o
Article history:
Received 24 March 2011
Received in revised form 12 November 2011
Accepted 26 November 2011
Available online 7 December 2011
Keywords:
Rock fabrics
Spatial distribution
Clustering
Multiple-area density map
Grain growth
Pinning effect
a b s t r a c t
The most widely used method for quantitative analyses of the spatial distribution of grains in a rock body is
the nearest-neighbor method (a position-based method), which recognizes the grain center as the position of
the grain without consideration of grain size or shape. However, the spatial distribution of grains is
inuenced by their size and shape, as well as their position. Here, we propose a multiple-area density map
(MADM) method to quantify the spatial distribution of phases or grains. The method is based on image
analysis and simultaneously considers the position, size, shape, and proportion of grains. The MADM
constructed by overlaying density maps of grain areas with a set of template size produces a normalized
standard deviation (NSD) value of phase area density, which represents the degree to which it is spatially
clustered. The NSD value is used to quantify the distribution of the phase, without considering individual
grains. To identify the spatial distribution of individual grains, the method employs the clustering index
(CI), which is calculated from the ratio of NSD to the reciprocal of the number of grains in a loglog plot.
2011 Elsevier B.V. All rights reserved.
1. Introduction
A key factor in interpreting the origin and evolution of rocks is the
rock fabric, which may be dened as the spatial and geometrical
congurations of its components (Gaillot et al., 1999; Hobbs et al.,
1976). Previous studies have proposed methods for quantifying the
grain size and shape (e.g. Heilbronner and Keulen, 2006; Higgins,
2000; Panozzo, 1983), whereas relatively few studies have sought
to quantify the spatial distribution of mineral phases in the rock
mass (e.g., Higgins, 2000). Such studies have included analyses of
the spatial distribution of phases in the context of constraining the
nucleation processes of various phases in igneous and metamorphic
rocks (Jerram et al., 1996, 2003; Philpotts et al., 1998; Saltzer et al.,
2001), the identication of phases in equilibrium with each other
(Morishita and Obata, 1995), and assessing the effect of one phase on
the static or dynamic grain growth of another phase in metamorphic
rocks (Herwegh and Berger, 2004; Song and Ree, 2007). However,
existing methods for quantifying the spatial distribution of a given
phase do not provide a unique solution, since the quantication is
dependent on several factors that are not always taken into account,
including clustering, fraction, size, shape, and shape-preferred
orientation.
In this paper, we introduce a new method for quantifying the
spatial distribution of a given phase in a rock body using 2-D image
177
Fig. 1. (a) Example of the ASCII raster grid le format. Here, 0 represents non-target phase and 1 and 2 indicate target phase. (b) The bitmap image from the grid le of (a).
Fig. 2. (a) A template to calculate area density of objects on the input grid. The calculated density value within the template is allocated at the cell that is located in the center of the
template in order to make area density map (ADM). (b) The constructed ADM from (a).
178
Fig. 3. (a) Single ADMs. The density contrast of an ADM depends on the used template size. (b) 3-D topography of a compiled multiple area density map (MADM) from a set of
single ADMs. This compiled MADM can also be represented as 2-D map as in (a).
we assume that all of the marginal sides of the grid are connected
with their opposite sides, resulting in a repetition of the pattern in
the same manner as decorative tiles are repeated in architecture.
This tiled boundary effect allows the method to calculate a
complete density value for the grid edges, which would otherwise
be missing data.
The calculated area density value depends on the size and shape of
the template used. The smaller the template, the more abrupt the
change in the calculated area density from one cell to the next,
enabling small variations in area density to be distinguished. However,
the larger the template, the easier it is to represent the relationship
between grains, since the method can only express relationships
between grains when they are both within the same template.
To offset these limitations related to the dependence of the calculated area density on the template size, a set of ADMs is produced
using multiple templates, each with a different size. Then, these
maps are combined into a multiple-ADM (MADM) by calculating
the average density value at each grid cell from the set of ADMs
(Fig. 3). The maximum possible size of a given template is the same
as the dimensions of the input grid, and its minimum size should be
the diameter of the smallest grain present, to enable grains of that
size to be distinguished. The size interval between each of the
templates should be constant. The number of templates used to
Fig. 4. (a) and (b) Example of 3-D area density map with two objects. Input image is
shown as a square box in the top-right side. Samples of (a) and (b) have the same
size and shape of objects but different distance between them. (c) Proles of two
MADMs which are cut in the middle of the samples of (a) in broken line and (b) in
line. Notice that the area density curve of the sample (b) having a closer distance
between the objects shows a higher amplitude than that of (a).
Fig. 5. Maximum standard deviation (SD) curve estimated using ideally clustered
objects (i.e. circular aggregate) for a given fraction of object. Open circles represent
the maximum SD of representative samples.
calculate the MADM can vary, but 10 ADMs per MADM has been
found to be appropriate: the use of more than 10 ADMs results in
excessive calculation time, while the use of too few ADMs results in
discontinuous and abrupt changes in density on the resultant
MADM. When comparing the clustering degree of two or more
samples, the same parameters and the same template sizes should
be used, since a change in the diameter of the template can result in
changes to the calculated density on a map.
179
Fig. 8. (a) Box plots of normalized density (ND) for samples in Fig. 7. The distribution of
ND values is highly asymmetric in clustered samples. (b) Standard deviation (SD) and
average value of area density for samples of (a). The average value of area density is the
same for all the samples since they have the same fraction of grains.
The MADM has two useful characteristics. First, the density values
of the MADM increase in proportion to the concentration of the target
objects. In other words, the MADM represents the spatial distribution
of the objects. Second, if samples contain the same fraction of a target
phase, the average density values of their MADMs are equal to the
fraction of the target phase regardless of its spatial distribution.
Fig. 7. Samples for verication of the multiple-area-density-map (MADM) method. The size, shape and fraction of grains are the same in all of the samples. The standard deviation
(SD) of MADM is shown both in 2-D and 3-D in each sample.
180
Fig. 4a and b shows samples with two grains (or objects) of the
same size and shape; however, the distance between the grains is
different in each case. Fig. 4c shows the density curve proles, taken
for the center of the samples, for the ADMs for both Fig. 4a and b.
The density curve of the sample with a shorter distance between
grains (Fig. 4b) has a higher amplitude than that of the sample with
a longer distance between grains (Fig. 4a). The distance between
grains in this example is the only dependent parameter causing the
difference in the density value. Therefore, the increased amplitude
is caused by the tighter clustering of the grains. When objects are
dispersed, the amplitude of the density is smaller; it approaches the
average density value as maximum dispersal is approached. Therefore, the spatial distribution of objects can be represented by the
deviation of density values from the average density for the map.
The smaller the deviation of density values from the average density,
the greater the dispersion of objects, and vice versa.
(dashed portion of the line in Fig. 5); this deviation is due to the
above-mentioned tiled boundary effect of the proposed method.
Although the NSD quantitatively denes the spatial distribution of
objects, it does not include any information on the frequency of
individual grains (i.e., the number of grains) or their size. In studies
of natural rocks, the spatial distribution of individual grains may be
more meaningful than that of a given phase (Higgins, 2006). To
extract the spatial distribution of individual grains from the calculated
NSD, we need information on the size of the grains, because the spatial
distribution (or clustering) of the grains is dependent on their size and
size distribution. For example, if each of the two objects shown in
Fig. 4a represents a single grain, the two grains are not strongly
clustered. In contrast, if each of the objects is an aggregate consisting
Fig. 9. Clustering index (CI) value for samples of Fig. 7 in a loglog plot of normalized
standard deviation (NSD) vs. reciprocal of number of grains (np). CI decreases with
increasing the degree of clustering.
Fig. 10. Clustering index (CI) plot for samples with various grain size, fraction and
spatial distribution. (a) Calculated CI of the samples is plotted on the discrimination
diagram of spatial distribution. (b) Sample images used for (a) are shown on the
discrimination diagram. The detailed parameters of the samples are shown in Table 1.
log NSD
log NSD
log np
log 1=np
in Table 1. Samples 006, 007, and 008 form a set with the same size,
shape, and fraction of grains, but have a different spatial distribution.
Other sets with the same properties for their grains, but different
spatial distributions, include the set comprising samples 020 and
023, and the set comprising samples 021 and 024. Samples 028*
and 029* are composed of needle-shaped grains; their grain fraction
and spatial distribution are the same as those of 020 and 023, respectively. As seen in Fig. 10a, the samples with needle-shaped grains
tend to have a higher CI value than their counterparts with circular
grains, although the difference in CI is not signicant. The CI values
for the samples with the same fraction and distribution, but different
grain shapes, tend to become higher with increasing dispersion of
grains, suggesting that the effect of grain shape on the spatial distribution becomes more signicant when the grains are more widely
distributed.
5.2. Analysis of the pinning effect of second-phase particles
Impurities, or second-phase particles, are important for the
stabilization of the grain size of the main phase during dynamic and
static recrystallization, and thus for the rheology of rocks and metals
(e.g., De Bresser et al., 1998, 2001; Etheridge and Wilkie, 1979; Evans
et al., 2001; Herwegh and Berger, 2004; Olgaard, 1990; Song and Ree,
2007). Most of these previous studies focused on the effect caused by
the fraction of second-phase particles present; however, the dispersion of second-phase particles is also an important factor in terms of
the recrystallized grain size of the main phase (Olgaard and Evans,
1986; Song and Ree, 2007; Weygand et al., 2000). In this section,
we test the proposed method in quantifying the effect of secondphase particle dispersion on the recrstallized grain size of the main
phase, using a conventional computer simulation and a natural rock
sample.
We used the Mesoscale Microstructure Simulation Project (MMSP)
to simulate grain growth of the main (matrix) phase using Monte
Carlo simulations (Gruber et al., 2009) and employed the method of
Miyake (2001) to model the pinning effect of the second-phase particles
during static grain growth of the main phase. The size of each input
Table 2
Analyzed results of 2D grain growth simulations.
Sample
MCS
dg
ng
Sample_006
6000
10,000
40,000
6000
10,000
20,000
6000
10,000
30,000
6000
10,000
30,000
6000
10,000
70,000
6000
10,000
70,000
6000
10,000
80,000
6000
10,000
40,000
6000
10,000
60,000
39.7
41.8
46.2
42.7
46.1
48.9
39.3
42.0
46.3
55.5
65.2
91.8
58.3
74.9
117.9
52.3
59.8
74.2
55.9
64.1
91.6
52.7
59.5
85.6
52.1
63.3
79.0
100
86
66
91
80
73
99
82
67
52
38
20
46
29
11
57
44
21
51
37
12
60
45
23
56
38
19
0.440
0.458
0.492
0.465
0.491
0.511
0.437
0.460
0.493
0.337
0.391
0.506
0.242
0.326
0.480
0.316
0.361
0.434
0.228
0.274
0.395
0.319
0.360
0.482
0.315
0.381
0.455
Sample_007
Sample_008
Sample_020
Sample_021
Table 1
Analyzed results of the samples in Fig. 10.
Sample
fp
dp
np
Std. Dev.
NSD
CI
Sample_006
Sample_007
Sample_008
Sample_020
Sample_021
Sample_023
Sample_024
Sample_028*
Sample_029*
0.052
0.052
0.052
0.051
0.052
0.051
0.052
0.051
0.051
10.8
10.8
10.8
20.4
28.6
20.5
28.4
20.5
20.5
91
91
91
25
13
25
13
25
25
0.0165
0.0058
0.0270
0.0101
0.0167
0.0407
0.0516
0.0088
0.0407
0.210
0.075
0.344
0.132
0.213
0.526
0.663
0.113
0.526
0.35
0.58
0.24
0.63
0.60
0.20
0.16
0.68
0.20
*Samples with anisotropic grain shape. fp: fraction of particles, dp: diameter of particles,
np: number of particles, Std. Dev.: standard deviation, NSD: normalized standard
deviation, CI: clustering index.
181
Sample_023
Sample_024
Sample_028*
Sample_029*
MCS: Mote Carlo steps, dg: diameter of grains, ng: number of grains, m: geometric factor
of particles.
182
matrix is 500 500 cells. The data from the samples shown in Fig. 10
were used for the second-phase particles during the growth simulations.
The initial matrix grain size (of one or two pixels) was smaller than that
of the second-phase particles in all samples. The growth simulation was
run for each sample until the size of matrix grains stabilized (a
maximum of 100,000 Monte Carlo Steps (MCS)).
When impurities or second-phase particles are present during
grain growth, the relationship between the maximum size of matrix
grains and the properties of the second-phase particles (Zener drag)
can be expressed as follows:
dmax C
dp
fm
Fig. 11. Histograms representing size distribution of matrix grains in the samples simulated at 6000 (early) and 10,000 (middle) MCS (Monte Carlo steps) and at the stabilized
stage. The detailed parameters of the samples are shown in Table 2.
183
Table 3
Parameters and analyzed results of the quartzite.
Sample
fp
dp
np
SD
NSD
dg
ng
CI
Area_01
Area_02
Area_03
Area_04
Area_05
Area_06
0.016
0.034
0.079
0.026
0.037
0.055
40.66
40.26
49.24
43.51
46.80
43.75
67
134
199
92
110
182
0.0041
0.0092
0.0141
0.0054
0.0078
0.0123
0.139
0.170
0.130
0.125
0.131
0.150
163.8
136.2
115.8
164.6
144.7
130.9
217
315
424
217
274
327
0.47
0.36
0.38
0.46
0.43
0.37
2.48103
1.19103
6.27102
1.69103
1.25103
7.94102
0.34
0.36
0.34
0.36
0.34
0.38
fp: fraction of particles, dp: diameter of particles (unit: m), np: number of particles, SD:
standard deviation, NSD: normalized standard deviation, dg: diameter of grains (unit: m),
ng: number of grains, CI: clustering index, Z: Zener parameter, m: geometric factor of particles.
The size distribution of area 02, which has a lower CI value, is more
asymmetrical than that for area 05, and it has a higher frequency of
small grains (Fig. 14). However, the difference in size distributions
between these areas is not as signicant as that obtained in the
simulations above, possibly due to complications arising from
measuring objects which appear to be generally needle-shaped in
2-D but are actually plate-shaped in 3-D.
5.3. Phase distribution analysis of a poly-phase rock
Jerram and Cheadle (2000) analyzed the spatial distribution of
major minerals in a granulite using the CLHCA method, which is
based on the grain-center distribution technique. They interpreted a
random distribution for pyroxene and scapolite, but clustering for
sphene. They attributed the clustering to restrictions on sphene
growth imposed by pyroxene and scapolite grains. We analyzed the
images of Jerram and Cheadle (2000) using the proposed method
Fig. 12. (a) Photomicrograph of the quartzite sample used for the analysis. (b) Manual traces of grain boundaries and the analyzed areas.
184
Fig. 13. Histograms representing size distributions of quartz grains in analyzed areas. fp: fraction of mica. CI: clustering index. Z: Zener parameter.
(Fig. 15), yielding CI values for pyroxene and scapolite of 0.27 and
0.25, respectively, indicating that these grains are strongly clustered
(Table 4). The sphene grains, in contrast, are weakly clustered with
a CI of 0.42. Thus, our results conict with those obtained by the
CLHCA method, probably because the proposed method focuses on
the proximity of grains rather than their positions. This point is
discussed in the following section.
6. Discussion
Analytical methods for calculating the spatial distribution of a
phase can be classied into two types: position- and proximitybased methods. The position-based methods use the coordinates of
an object's center to dene its position without consideration of its
size or shape. These methods include the nearest-neighbor (or Big
R; Clark and Evans, 1954; Jerram et al., 1996) and CLHCA (Jerram
Fig. 14. Comparison of the size distribution for Areas 2 and 5. The size distribution of
Area 2 is more asymmetric when compared to that of Area 5.
185
Fig. 15. Separated phase images and constructed MADM for the sample used in Jerram and Cheadle (2000). (a) pyroxene, (b) scapolite, (c) sphene, and (d) manually traced image
of the sample.
Table 4
Analyzed results of the sample of Fig. 15.
Mineral
Fraction
SD
NSD
CI
Sphene
Pyroxene
Scapolite
0.05
0.57
0.49
0.010
0.055
0.063
0.141
0.222
0.244
0.42
0.27
0.25
SD: standard deviation, NSD: normalized standard deviation, CI: clustering index.
Fig. 16. Effect of preferred orientation of aggregates on spatial distribution for layered (a) and locally clustered (b) samples. Both samples have the same size, shape and fraction of
objects. (c) Box plots for density values of the two samples.
186
Table 5
Analyzed results with anisotropic templates for some samples in Fig. 10.
NSD
CIR
HOR
VER
HOR/CIR
VER/CIR
HOR/VER
Sample 020
Sample 023
Sample 028*
Sample 029*
0.0101
0.0106
0.0105
105%
103%
101%
0.0407
0.0517
0.0281
127%
69%
184%
0.0088
0.0103
0.0079
118%
91%
130%
0.0407
0.0517
0.0279
127%
69%
185%
NSD: normalized standard deviation, CIR: circular template, HOR: elliptical template
with horizontal long axis, VER: elliptical template with vertical long axis.
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