Journal of Petrology Advance Access originally published online on February 15, 2007
Journal of Petrology 2007 48(4):693-709; doi:10.1093/petrology/egl078
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Do We Really Need Mantle Components to Define Mantle Composition?
Dipartimento Di Scienze Della Terra, Università Di Pisa, 56126 Pisa, Italy
RECEIVED AUGUST 3, 2006; ACCEPTED DECEMBER 18, 2006
| ABSTRACT |
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We discuss the concept of components in the Earth's mantle starting from a petrological and geochemical approach, but adopting a new method of projection of geochemical and isotopic data. This allows the compositional variability of magmatic associations to be evaluated in multi-dimensional space, thus simultaneously accounting for a large number of compositional variables. We demonstrate that ocean island basalts (OIB) and mid-ocean ridge basalts (MORB) are derived from a marble-cake mantle, in which different degrees of partial melting of recycled lithosphere, which are heterogeneous in age and composition, contribute to the magma genesis. This view is supported by the variability in the geochemical and isotopic signatures of OIB that are observed on the scale of a single ocean island as well as on that of an ocean, mostly varying between two extreme compositions, that are not strictly related to the commonly accepted mantle components (DMM, EMI, EMII, HIMU). Rather they are a distinctive feature of the mantle source sampled at each ocean island and are strongly dependent on the Pb isotope system. We recommend a change in perspective in studies of MORBOIB geochemistry from one based on physically distinct mantle components to a model based on the existence of a marble-cake-like upper mantle. Although resembling the statistical upper mantle, this model implies that geochemical homogenization can be attained only within the limits of local mantle composition, so that a world-wide uniform depleted reservoir cannot be sampled by simply extending the volume of the region undergoing partial melting.
KEY WORDS: geochemistry; isotope; mantle; OIB
| INTRODUCTION |
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The isotopic heterogeneity of oceanic basalts [mid-ocean ridge basalts (MORB) and ocean island basalts (OIB)] has been described by many researchers in terms of the interaction of a small number of mantle components [Depleted Mantle (DMM); Enriched Mantle I (EMI); Enriched Mantle II (EMII); High-µ (HIMU); White, 1985
The conventional view on the origin of basaltic magmas (sensu lato) assigns a major role to variable degrees of partial melting of a peridotite source (McKenzie & O'Nions, 1991
). At least at high pressures, and for relatively Ol-rich melts, experimental data on peridotite melting could explain the compositional variability of most near-primary OIB lavas (e.g. Keshav et al., 2004
). However, there is increasing recognition of the role played by olivine-poor sources in the genesis of mantle partial melts (e.g. Carlson & Nowell, 2001
; Sobolev et al., 2005
; Fig. 1). Even if the dominant source of basalts is the convecting asthenopheric mantle, the process of subduction provides an efficient mechanism for the continuous recycling of pyroxenite-veined oceanic lithospheric mantle and of its cap of MORB and its differentiates. The Ca-TschermakOlivineQuartz (CaTsOlQ) diagram of Fig. 1 illustrates the compositions of a large dataset of OIBs along with relevant peridotite and pyroxenite melting relations. Following Hirschmann et al. (2003
), it seems likely that less alkaline basic melts (tholeiites, picrites, picrobasalts) are mostly linked to high degrees of partial melting of a rather shallow peridotite source, whereas more alkaline melts (nephelinites, basanites, alkali basalts), although reflecting a deeper origin at lower partial melting degrees, may be also linked to an enriched source. Mantle sources sampled by these alkaline melts may be related to melting of metasomatic pyroxenite veins, as well as to the solid residuum of the extraction of silicic melts from an eclogitic source (Hirschmann et al., 2003
). Nevertheless, other researchers have denied any important role for pyroxenitic material in the chemical budget of OIB (Keshav et al., 2004
; for a recent review on this topic refer to Lustrino, 2006
).
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The wide variety of mantle mineral assemblages that can account for the genesis of the spectrum of MORBOIB primary melts suggests that individual basic magmas should inherit an isotope signature reflecting the heterogeneity of the specific mantle portion in which partial melting occurred. Meibom & Anderson (2003
In this paper we use the following definitions:
compositional parameter, a geochemical variable used to define the composition of samples (concentrations or elemental and isotope ratios);
mantle component, an extreme in geochemical composition existing independently of the chosen set of compositional parameters adopted for its identification, hence it should be identifiable in all the sub-spaces defined by the compositional parameters;
end-member, a fixed geochemical composition defined by a set of n compositional parameters; mixing of a given number of end-members is able to generate all the compositions found in a set of analyses of natural samples;
mantle reservoir, a mantle portion, physically distinct and potentially accessible, that may result from mixing of mantle components.
We discuss the concept of mantle component with respect to the evaluation of some key processes responsible for MORBOIB heterogeneity. We assess the range of isotope and trace element variability of oceanic basalts and bind them simultaneously to a large number of compositional parameters using a novel multi-dimensional data plotting approach. This systematic and simultaneous evaluation of both trace element and isotopic data provides a more robust insight into the chemical structure of the mantle.
| METHOD OF PROJECTION OF GEOCHEMICAL DATA |
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An n-dimensional space (Rn) relative to n (n
3) independent variables can be projected into three-dimensional (3D) space (R3) by choosing four points (hereafter referred to as end-members; Table 1) that play the role of generating the R3 space into which the dataset in Rn is to be projected. End-members can assume an arbitrary position in R3 and represent the image of four points in Rn: they must not be linearly dependent (i.e. non co-planar), both in R3 and in Rn, and allow rescaling of the position of all data points in Rn into R3 by projection (Albarède, 1995
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To allow evaluation of this new method of projection, two Excel files (anamorfosis.xls and data.xls) are provided for downloading from http://www.petrology.oxfordjournals.org. The use of these files is straightforward and self-explanatory. Details of the method of projection are given in Appendix A. The Excel files are set for the Italian language by default. Provide in cells A2-E2 the denomination for the graph window in the language your computer is set: it is required for the proper setting of the basic code. It is a requirement to assign the same set of n compositional parameters to describe the geochemical compositions of the four end-members, represented at each tetrahedron vertex (cells Q39T48 in anamorfosis.xls), as well as to provide the data to process in data.xls. The data file of interest should be formatted exactly as in data.xls (e.g. using the copy/paste function of Windows and overwriting the analyses in the sample file), and its pathname has to be reported in cell N3 of the tetrahedron spreadsheet of anamorfosis.xls. The number (n) of the compositional parameters to be plotted can vary between three and ten, and each parameter can be included or excluded from the evaluation of the tetrahedral coordinates (
1,
2,
3,
4) of each point, by simply setting to one or zero the values given in cells U39U48 in anamorfosis.xls. Macros in anamorfosi.xls allow the program to run all the calculations automatically to process the data for projection, by using the coloured buttons in the tetrahedron spreadsheet. The comments in this sheet may be checked to view the defined values and obtain more detailed information. Buttons are pressed to load (Load data button), then project (ANAMORFOSIS) and finally plot (Plot data) data, as well as to rotate (vertical rotation and horizontal rotation) the tetrahedron. The addition or suppression of one or more compositional parameters, as well as the choice of a different end-member, requires recasting of the projection by pressing again the ANAMORFOSIS button in anamorfosis.xls. The spreadsheet can be saved with a new name but, in this case, the new name must be updated in cell N1 in sheet tetraedro. | GEOCHEMICAL AND ISOTOPIC VARIABILITY OF MORB AND OIB |
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We compared trace element and isotopic (Sr, Nd, Pb) data for oceanic alkali basalts, basanites, nephelinites, picrites and tholeiites, representative of OIB magmatism, and MORB data, from the Pacific, Atlantic and Indian oceans from the GEOROC database (http://georoc.mpch-mainz.gwdg.de/Start.asp). Hf isotope data are too sparse to be processed together with the SrNdPb isotope data. We selected about 1500 analyses for which loss on ignition is less than 2· 2 wt % and mg-number is >63. In our selection, the composition of olivine in equilibrium with the bulk-rock ranges between Fo 63 and 85, assuming Kd(Fe/Mg) = 0· 30 (Roeder & Emslie, 1970
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For a variety of basalts from MOR (Atlantic, Pacific, Indian) and EMI (Pitcairn), EMII (Society and Samoa) and HIMU (Tubuai, Rurutu and St. Helena) oceanic islands (http://georoc.mpch-mainz.gwdg.de/Start.asp), we calculated the average arithmetic values for the 208Pb/204Pb ratio and several incompatible trace element abundances, characterized by different ratios of charge/ionic radii, and geochemical behaviour in igneous processes. We selected suitable trace element ratios (e.g. Ce/Pb, Nb/U, La/Sm, Rb/Ba, etc.) to discriminate OIB on the basis of source- and/or process-related geochemical characteristics (Table 2). We constrained the geochemical compositions of the four mantle components of Hart et al. (1992
10), thus using up to six extra trace element and/or isotope ratios. We note that even the addition of only one variable (n = 4) to the three considered by Hart et al. (1992
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For 4
n
10, samples from each oceanic island (e.g. Canary Islands, St. Helena, Hawaii, etc.) describe sub-parallel alignments in the pseudo-plane, showing geochemical variability that may cover the entire compositional range observed for the OIB dataset as a whole (e.g. Zindler et al., 1984
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Each ocean island may show multiple extreme compositions, especially those characterized by complex petrogenetic history, e.g. note the various alignments described by Hawaii magmas (Gaffney et al., 2005
With the new choice of compositional parameters, samples with geochemical characteristics close to the Hart et al. (1992
) mantle components (e.g. St. Helena = HIMU sensu stricto, Society = EMII sensu stricto, etc.) do not cluster close to the vertices of the tetrahedron but form sub-parallel elongated trends in the pseudo-plane, independent of the position of the Hart et al. (1992
) end-members (Fig. 3). Significantly, MORB also spread out from the DMM vertex, revealing the intrinsic variability of their mantle source (Fig. 3; e.g. Hofmann, 2003
; Salters & Stracke, 2004
; Workman & Hart, 2005
). The so-called FOZO (Hart et al., 1992
) and EAR (Enriched Asthenospheric Reservoir; Hart et al., 1992
; Granet et al., 1995
; Stracke et al., 2005
; Lustrino & Wilson, 2006
) do not hold any key position in this new projection (Fig. 3). Consequently, samples with the isotopic compositions of the Hart et al. (1992
) components cannot properly describe the compositional variability of OIB and MORB, unless this is restricted to the isotopic ratios of Sr, Nd and Pb (206Pb/204Pb). This picture is not significantly affected by redefinition of the compositions of Hart et al. (1992
) end-members; for example, adopting isotope ratios as suggested in the recent literature for DMM, EMI, EMII and HIMU (e.g. Workman et al., 2004
; Stracke et al., 2005
).
As the tetrahedron is simply a tool with which to visualize the R3 space for the projection of points from Rn, it may be dropped, with the focus being moved to the point distributions and clusterings. Thus it is possible to explore a more appropriate choice of end-members to obtain projections that better highlight the trends of interest; for example, allowing the dataset to reveal its planar distribution for n
4 (Table 3; Figs 4 and 5), regardless of arrays positions with respect to the tetrahedron. From this perspective, if samples are tagged on the basis of their major element composition (e.g. classified on the TAS diagram; Figs 1 and 4a and b), picrites, along with OIB tholeiites (most of the tholeiite samples are from the Hawaii database) and some alkali basalts, independent of their provenance, mainly cluster to form a well-defined alignment (see inset in Fig. 4a for Hawaii). The alkali basalts, which form part of this trend, have major element characteristics that are similar to those of picrites and fall on the picrite array (P < 2 GPa) in the CaTsOlQ diagram shown in Fig. 1. Nephelinites, basanites and the other alkali basalts spread on OIB arrays that diverge from the picritetholeiite trend, pointing to different end-members (Figs 4 and 5). The two different alignments are not an artefact of the choice of adopting both process-related and source-related compositional parameters. Actually, the trends described are evident also if only tracers of source composition are selected as variables (e.g. isotopes, Th/U, Nb/U, etc.; Fig. 4b). This would suggest that the range of tholeiitepicrite vs basanitenephelinite trends does not depend upon different degrees of partial melting.
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Data for modern oceanic sediments (from Plank & Langmuir, 1998
Also in the projection of Fig. 5, strong correlations between Sr and Nd isotopes and/or 207Pb/204Pb208Pb/204Pb and 206Pb/204Pb, such as the mantlecrust array or the Northern Hemisphere Reference Line (NHRL; Hart, 1984
), do not affect the distribution of points in Figs 4 and 5 and do not define linear trends on the pseudo-plane.
Mixing equations involving trace element ratios in Rn (Langmuir et al., 1978
) can be used to calculate mixing curves in n-dimensional space, and the resulting curves can also be projected in R3. Physical mixing between the pairs of distinct end-members of each oceanic island or archipelago can account for its compositional variability (Fig. 5). Consequently, in this diagram OIB lie on a family of sub-parallel curves.
If incompatible trace element ratios alone (n = 5, ... , 10) are adopted, or Pb isotope ratios are not included among the compositional parameters (e.g. selecting Rb/Ba, Th/Yb and La/Nb and/or 87Sr/86Sr and 143Nd/144Nd ratios as in Fig. 6), the pseudo-plane defined by most of the OIB data collapses into a single alignment. The main trend lies on a mixing curve on which the various extreme compositions tend to merge into apparently only two end-members. Consequently, OIB compositional variability seems to be strongly controlled by two main end-members, in turn dependent on Pb isotope ratios. Even if data overlap is evident along this alignment, nephelinitesbasanitesmost alkali basalts tend to cluster near one of the two extreme compositions, whereas tholeiitespicritesfew alkali basalts are more representative of the composition of the other end-member. The basalts and sediments that in Fig. 4a plot away from the pseudo-plane spread perpendicularly to the trend of the main data array.
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We emphasize that these conclusions can be verified for any sets of compositional parameters not including Pb isotopes (e.g. Ce/Pb, La/Sm, Nb/U and 87Sr/86Sr, 143Nd/144Nd). It should be noted that this Pb-effect appears to be little influenced by the specific choice of the Pb isotope parameter plotted, as such spreading on the pseudo-plane is induced by any kind of Pb isotope ratio included among the compositional parameters. Otherwise, because of the scarcity of Hf isotope data in OIB databases, the effect of these isotopic ratios on the arrangement of data points in the tetrahedron cannot be strictly constrained. The limited Hf isotope data available confirm the similar behaviour of the Nd and Hf isotope systems, making it possible to switch from one compositional parameter to the other, without affecting the multi-dimensional distribution of data.
We made several attempts to verify this observation by replacing the arithmetic average values with extreme (minimum and maximum) values of 208Pb/204Pb and trace element abundances for the Hart et al. (1992
) end-members, without noticing any significant deviation from the above conclusion. We further considered the possibility that the use of compositional parameters involving U/Pb and/or Th/Pb ratios might account for spurious correlations, because of the presence of reliant variables, or distort intra-oceanic correlations because of the scarce correspondence between Pb and SrNd isotope ratios. Nevertheless, even if we replace 206Pb/204Pb with 208Pb*/206Pb* (the ratio of the radiogenic additions to the initial terrestrial lead, defined as [(208Pb/204Pb) (208Pb/204Pb)init]/[(206Pb/204Pb) (206Pb/204Pb)init]; Tatsumoto et al., 1973
; Hofmann, 1997
), which linearly correlates with Sr and Nd isotope composition, or
7/4 Pb with 207Pb/204Pb (Hart, 1984
), the distribution of data in multi-dimensional space (n
4) still matches the above-mentioned correlations. We also verified that such relationships are still evident if only the most primitive OIB samples are selected (mg-number >70).
| DISCUSSION |
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The proposed method of plotting multi-parameter datasets from n-dimensional space to R3 allows a comprehensive analysis of the effects of a large number of independent compositional parameters at the same time, once a proper set of end-members at the vertices of the tetrahedron has been defined. This represents a substantial improvement with respect to the adoption of a fixed reference system tied to a maximum of three independent variables (e.g. Hart et al., 1992
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Even if we have explored a large number of compositional parameters, in principle we cannot exclude that we may have missed some key geochemical tracers. Mathematically speaking, if any significant chemical species is responsible for the point spreading, its neglect is equivalent to perform a projection of the dataset onto an R(n1) space that is perpendicular to the spread in Rn. This implies loss of the dataset variability in the chosen projection (i.e. it occurs when Pb isotopes are excluded).
The planar distribution of data in R3 suggests that OIB compositional variability is characterized by two degrees of freedom. As three points are enough to define a planar distribution in R3, we might be tempted to relate the observed variability to three distinct end-members. Three mantle components have been previously invoked to explain the isotopic variability of OIB, distributed on a plane in any 35-dimensional isotope space (Zindler et al., 1982
). However, the three end-members are not geographically located, as extreme compositions on the pseudo-plane are not associated with any specific archipelago or, more generally, with the ocean of origin; they cannot be defined as mantle components, as the components necessary to define each magmatic suite are distinct and different, and depend on the choice of the compositional parameters (e.g. including or excluding Pb isotopes). The Hart et al. (1992
) end-members do not represent extreme geochemical compositions within the entire MORBOIB dataset and they are not appropriate to explain the observed variability of OIB sources by physical mixing, even if they can apparently satisfactorily describe their SrNdPb isotopic characteristics.
Different pairs of compositional extremes could account for most of the compositional variability recorded in each archipelago (Fig. 7a). If Pb isotopes are not included in the set of compositional parameters, the distribution on the pseudo-plane collapses into a single array, thus the OIB geochemical variability can be related to only two distinct end-members. Three general considerations can help constrain the nature of the extreme components in MORBOIB, by linking petrological and geochemical evidence:
- picritestholeiites and some alkali basalts mostly cluster towards one of the two end-members and are probably characterized by shallow depths of origin and/or large degrees of partial melting of peridotitic, eventually pyroxenitic, sources (Figs 1, 4 and 5);
- the sources of basanitesnephelinites and most alkali basalts show affinities with the other extreme composition and seem to be mostly related to deep mantle sources (Figs 1, 4 and 5);
- The effect of including Pb isotope ratios seems to enhance the heterogeneity of OIB sources (Fig. 7a).
End-members in OIB and MORB mantle sources do not show a fixed geochemical composition and are unlikely to reflect physically accessible mantle reservoirs. The complex variety of compositions along the array(s) may result from the various processes that cause mantle heterogeneity, such as depletion by melt extraction or enrichment by metasomatism, or recycling of subducted or delaminated lithospheric segments. If Pb isotopes are not among the compositional parameters, any set of end-members seems to generate a single linear distribution of OIBMORB data (Fig. 7b). Magmas generated under largely different partial melting degrees mostly lie at the opposite extremes of this alignment, although both nephelinitebasanitealkali basalt and tholeiitepicrite magmas overlap in composition. Therefore, diverse mantle processes (e.g. enrichment by recycling and depletion by melt extraction) appear to pervasively affect mantle sources independently of the depth at which they are located.
If OIBMORB mantle sources were generated only from sources plotting at the two extremes, a marked bimodal arrangement should characterize the observed distributions. Similarly, if the source had an intermediate composition, a cluster of data points would be evident. In this case, each ocean island might be expected to record the fingerprint of a mantle component (or mix of mantle components), thus inheriting a well-defined and restricted geochemical composition. Moreover, this scenario would suggest the existence of enriched sensu stricto (e.g. basanitesnephelinitesalkali basalts) or depleted sensu stricto (e.g. tholeiitespicrites) magmas, thus calling for the presence of distinct mantle reservoirs. Indeed, the continuous distribution of data along the OIB mixing trends testifies to the existence of a wide spectrum of melts in each ocean island. Both the collection of melts from a definite mantle source region and mixing of magmas from distinct mantle sources are able to explain the observed arrays of OIB data. Thus each ocean island reflects the scale of local mantle heterogeneity by showing its typical range of geochemical variability (Fig. 7b). Therefore, the concept of mantle component is strictly related to the mantle portion(s) sampled at any specific ocean island (Figs 4 and 5). Extreme geochemical compositions and the whole range of intermediate compositions may coexist independently of the degree of partial melting (e.g. as commonly observed at Hawai), supporting the hypothesis of a marble-cake mantle. However, we consider that the model of the statistical distribution of mantle heterogeneity (Meibom & Anderson, 2003
; Anderson, 2006
) should produce geochemical homogenization within the limits of local mantle variability, so that a uniform depleted reservoir cannot be sampled by simply extending the volume of the region undergoing partial melting (Fig. 7b).
The inclusion of Pb isotopic ratios among the compositional parameters plotted, and the consequent spreading of trends in the pseudo-plane, reveals that each oceanic island does not simply differ in terms of the compositional range between each extreme composition (Fig. 7b). Because Nd and Sr isotope systematics, or elemental Pb in trace element ratios, do not induce differences in the data point distribution, we argue that such behaviour may be strictly related to the variation of U/Pb, Th/Pb and Th/U, and associated Pb isotope ratios, with respect to Sm/Nd or Rb/Sr in OIB mantle sources. This is confirmed by the use of 208Pb*/206Pb* and
7/4 as compositional parameters that do not cause the data to collapse into a single array, suggesting that the spreading of the OIB trends on the pseudo-plane is not a geometric effect of the scarce correlation between SrNd and Pb isotopes.
The discriminant power of Pb isotopes clearly seems to indicate a key role for geological time in characterizing OIBMORB geochemistry. Recycled oceanic crust, with its sediment veneer, is thought to be a common component in the mantle source of OIB, largely responsible for their chemical heterogeneity (Hofmann & White, 1982
; Chauvel et al., 1992
; Lassiter & Hauri, 1998
; Blichert-Toft et al., 1999
; Chauvel & Hemond, 2000
; Eisele et al., 2002
; Workman et al., 2004
; Stracke et al., 2005
). U/Pb variability and variability in the age of different portions of subducted lithospheric slabs adds a distinctive Pb isotope fingerprint to the recycling process. Recycling of geochemically diverse subducted plates and delaminated lithospheric keels (e.g. Lustrino, 2005
), each with unique U/Pb and Th/Pb values and residence time in the mantle, confers distinctive flavours to OIB mantle sources (e.g. Kelley et al., 2005; Stracke et al., 2005
). These are reflected by characteristic Pb isotope ratios in OIB from different oceanic islands, and are thus probably responsible for the observed range of sub-parallel trends in the pseudo-plane (Fig. 7). Thus, each ocean island appears to be characterized by its own range of compositional variability between its own geochemical end-members, with respect to recycling of peculiar lithospheric segments occurring in its local mantle source region. Sr and Nd isotopes in OIB do not seem to be such effective tracers of recycling processes, as differences in these isotope compositions in diverse subducted plates are not an effective discriminant (i.e. the fields of terrigenous and pelagic sediments largely overlap in the SrNd isotope space). This might be related to the fact that Rb/Sr and Sm/Nd do not fractionate as strongly as U/Pb and Th/Pb during the recycling process, thus leading to the more homogeneous SrNd isotope compositions of the enrichment agents. On the other hand, Pb isotope variability in OIB has traditionally been the basis on which the enriched mantle components or end-members (HIMU, EMI, EMII) required to describe mantle heterogeneity were defined (e.g. Weaver, 1991
; Hofmann, 1997
; Lustrino & Dallai, 2003
; Stracke et al., 2005
), reflecting the age and composition of recycled lithospheric materials in their mantle source.
| CONCLUSIONS |
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The chemical structure of the mantle can be constrained by the contemporaneous evaluation of the trace element and isotopic compositions of MORB and OIB. The choice of a particular set of geochemical parameters represents a filter through which mantle composition can be visualized, allowing a more independent perspective of the causes and nature of mantle heterogeneity. Multi-dimensional projections allow a broad view of large-scale mantle heterogeneities, accounting for several possible perspectives at once. The apparently complex projection scheme allows a change of coordinates to simplify the description of mantle compositions. This comprehensive evaluation of several compositional parameters reveals that each ocean island has its own local geochemical end-members, thus the so-called mantle components (DMM, EMI, EMII, HIMU; Hart et al., 1992
| SUPPLEMENTARY DATA |
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Supplementary data for this paper are available at Journal of Petrology online.
| APPENDIX A: THE PROJECTION SCHEME |
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The chemical composition of a system can be reported in terms of a set of n variables corresponding to a point in n-dimensional space. For a system in which four end-members, defined by a given set of components, represent a suitable basis (a basis for a vectorial space is a set of vectors that can generate the whole compositional space Rn to be projected into R3) the projection scheme is based on well-known procedures reported in detail in basic textbooks of linear algebra. In the projection scheme an n-tuple of values that defines the composition of system E
(E1 , E2, ... , En) is recast choosing the four end-members: |
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The orthogonal projection of the point E* in the 3D space through the end-members is obtained minimizing the n-dimensional Euclidean distance from the given point E.
Given that A, B, C and D
Rn, we compute the vectors
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Set
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Lastly, set
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For each point, we also compute the vector
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1w1 +
2w2 +
3w3, where |
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E' is the linear combination of w1, w2, w3 nearest E' in Rn. Please note the different apices appended to E and
definition. As the distance is translation-invariant, it follows that E' = D +
1v1 +
2v2 +
3v3 is the point in the 3D space passing through A, B, C, D nearest D + E' = E.
E' can be rearranged as
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i of E* with respect to the four vertices A, B, C, D: |
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From 
i = 1 it follows that each
i
1, thus the corresponding point lies within the array of the four end-members A, B, C, D and represents a physical mixture of the end-members. If some coefficient
i > 1 the constant sum imposes that one or more coefficient has to attain negative values; thus the point has to lie outside the envelope, a condition that suggests a different choice of end-members in order to express the data as physical mixtures of compositions plotted on the tetrahedron vertices.
The projection E' coincides with E if and only if E itself is a linear combination in Rn of the end-members with the sum of coefficients equal to one. Finally, we can map in R3 the four end-members A, B, C, D, by choosing a set of four points T1 , T2 , T3 , T4
R3. The choice T1 = (0, 0, 1); T2 = (2 x
2/3, 0, 1/3); T3 = (
2/3,
2/3, 1/3); T4 = (
2/3,
2/3, 1/3) corresponds to a regular tetrahedron.
Finally, E can be mapped in R3 onto E** by the relation
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For a generic orientation of the tetrahedron, it is possible to express its vertices, Ti = {xi, yi, zi}, as a function of the angle
of rotation around the z axis as
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. The rotation coordinates of its vertices are provided by |
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1,
2,
3,
4} of a generic point T, from the relation |
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Then
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Analogously,
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| APPENDIX B: SOME NUMERICAL TESTS |
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Adopting four arbitrary end-members EM1, EM2, EM3, EM4 (their compositions with respect to the 10 compositional parameters are given in Table B1), we generated a reference composition RC to plot in the centre of the tetrahedron. RC is thus the average composition for each compositional parameter C1C10 of the four end-members. RC is then manipulated to obtain four distinct datasets.
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Dataset A is generated by adding random amounts of the end-members to RC, the resulting data point distribution is completely contained within the tetrahedron and does not show any symmetry (Fig. B1). Conversely, datasets B, C and D are generated by adding variable proportions of each compositional parameter C1C10 to RC, through a random number generator. In set B, the same range of variability affects each compositional parameter and the resulting distribution is symmetric and perpendicular to C1 (the one with the maximum absolute values); moreover, points can plot outside the tetrahedron (Fig. B1). In sets C and D, different ranges of variability are allowed for each compositional parameter, the standard deviation of each one in set D is reduced by a factor of two with respect to set C. Specifically we took care to allow the largest standard deviation for C10 (the one with the minimum absolute value; Table B1).
Figure B1 shows the different symmetries and positions held by the four datasets. The resulting data arrays show a different spread; the wider distribution is attained by dataset C, which is the one characterized by the largest standard deviation (Table B1). Figure B1 also reports the projections of the versors corresponding to some components. Each versor Cj is drawn by linking RC to a composition for which Cj
j = 0 and Cj = 1. Alignments of the data array in sets C and D are controlled by the versor of the component with the largest absolute values. It is evident that the alignment of the data array in sets C and D are controlled by the direction (versor) assumed for the compositional parameter with the largest absolute values.
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| ACKNOWLEDGEMENTS |
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We thank D. Longo for assistance during the development of the new method of projection, and P. Rossi for helpful discussion on its implications in linear geometry. Constructive revisions by J.-M. Cebria, M. Lustrino and A. Stracke, and by two anonymous reviewers of an earlier version of this manuscript, helped us to clarify our ideas and are greatly appreciated. Financial support was provided by MIUR (20032005, prot. n° 2003041389_003; Poli, G.: Reattori caotiche e frattali: dinamiche non lineari e invarianza di scala nei sistemi magmatici).
*Corresponding author. E-mail: d.gasperini{at}dst.unipi.it
| REFERENCES |
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