Abstract
Gaussian quadrature rules are commonly used to approximate integrals with respect to a non-negative measure . It is important to be able to estimate the quadrature error in the Gaussian rule used. A common approach to estimating this error is to evaluate another quadrature rule that has more nodes and higher algebraic degree of precision than the Gaussian rule, and use the difference between this rule and the Gaussian rule as an estimate for the error in the latter. This paper considers the situation when is a Chebyshev measure that is modified by a linear factor and a linear divisor, and investigates whether the rules in a recently proposed new class of quadrature rules for estimating the error in Gaussian rules are internal, i.e., if all nodes of the new quadrature rules are in the interval . These new rules are defined by two measures, one of which is a modified Chebyshev measure . The other measure is auxiliary.
Keywords:
Gauss quadrature rule; averaged Gauss rule; generalized averaged Gauss rule; modified Chebyshev measure MSC:
65D30; 65D32; 33A65
1. Introduction
It is a common task in scientific computing to calculate approximations of integrals of the form
where is a non-negative measure and f is a real-valued integrand. A standard approach to evaluating such approximations when the coefficients of the recursion formula for the monic orthogonal polynomials that are associated with the measure are known or easily computable is to apply an ℓ-node Gaussian quadrature rule associated with the measure . A reason for the popularity of Gaussian quadrature rules is that they have maximal algebraic degree of precision: the Gaussian rule has algebraic degree of precision , which is maximal for all quadrature rules with ℓ nodes. Thus
where denotes the set of all polynomials of degree of at most ; see, e.g., [1,2,3,4,5] for details, including many applications as well as software.
It is important to be able to estimate the quadrature error
so that a suitable value of the number of nodes, ℓ, can be chosen. We would like to choose the number of nodes ℓ large enough so that the error (2) is smaller than a specified tolerance, but we do not want ℓ to be unnecessarily large, since this would entail the evaluation of the integrand at a needlessly high number of nodes.
A standard approach to estimating the quadrature error (2) is to apply another quadrature rule, , with nodes, with higher algebraic degree of precision than , and using the difference as an estimate for the quadrature error (2). This paper analyzes the properties of a new class of quadrature rules .
We consider the situation when the measure in (1) is a Chebyshev measure that has been modified by a linear factor and a linear divisor, i.e.,
where the parameters and are given by
for some constants . Clearly, implies that . We will consider “comparison quadrature rules” that are constructed with the aid of two measures, a modified Chebyshev measure and an auxiliary measure that also is defined on the interval . These kinds of two-measure-based quadrature rules were recently introduced in [6] and have been further studied in [7]. In these references, these rules were referred to as new averaged Gaussian (NAG) rules. We will use this acronym in the present paper also.
It is the purpose of this paper to investigate whether NAG quadrature rules that are associated with a modified Chebyshev measure of the form (3) and an auxiliary measure are internal, i.e., whether all nodes of live in the interval . This property is important when approximating integrals (1) with an integrand f that is defined only in the interval .
The classical approach to estimating the quadrature error in an ℓ-node Gaussian rule is to evaluate an associated -node Gauss–Kronrod rule; see Gautschi [3] as well as [8,9,10,11,12,13] for discussions on properties and applications of Gauss–Kronrod rules. Our interest in NAG rules stems from the fact that they are much easier to compute; see [14,15] for algorithms for computing Gauss–Kronrod rules. The evaluation of NAG rules will be discussed below.
Another approach to estimating the quadrature error in is to let the rule be the averaged rule, denoted by , associated with . This averaged rule is the average of and the associated -node anti-Gauss rule . Also, the averaged rule is much easier to compute than the Gauss–Kronrod rule associated with . Both anti-Gauss and averaged rules were introduced by Laurie [16]. More details on these rules will be provided below. For now, it suffices to note that they are not internal for all modified Chebyshev measures (3), and this is the reason for our interest in investigating whether certain NAG rules defined below are internal.
Spalević [17] (following Peherstorfer’s results; see [18,19]) proposed a variant of the averaged rule of Laurie [16] and referred to it as a generalized averaged rule. We will denote the generalized averaged rule associated with as ; it has nodes, similarly to the averaged rule introduced by Laurie, and, generally, has higher degree of algebraic precision. However, these rules are not internal for all modified Chebyshev measures (3) either. Their computation is discussed in [20,21,22].
It is convenient to write the measures (3) in the form
and to define the measures
where is one of the four Chebyshev measures,
Given monic orthogonal polynomials and their recurrence coefficients and for one of the measures , Gautschi [3] [Section 2.4] describes algorithms for computing monic orthogonal polynomials and their recurrence coefficients and for the measure , as well as monic orthogonal polynomials and their recurrence coefficients and for the measure . The averaged Gaussian quadrature rules and the generalized averaged Gaussian quadrature rules coincide with the -node Gauss–Kronrod quadrature rule for the measures for and are internal; see [23,24,25]. This paper therefore considers generalized averaged Gaussian quadrature rules for the measure .
Averaged and generalized averaged quadrature rules are applicable to all integrands that are defined and continuous only within the interval if they are internal. Djukić et al. [26] discuss two approaches to determining modifications of generalized averaged Gaussian quadrature rules with nodes in when the generalized averaged rule is not internal: (i) truncating the Jacobi matrix associated with the generalized averaged Gaussian quadrature rule and (ii) weighting the generalized averaged Gaussian quadrature rule. Djukić et al. [26] also investigate the internality of averaged and generalized averaged quadrature rules, and truncated variants of the latter, for the measures (5) and show that weighting yields internal generalized averaged rules if a weighting parameter is chosen properly. Bounds for this parameter that guarantee internality are provided.
This paper considers NAG quadrature rules that are determined by the measure as well as by an auxiliary measure . We will apply these rules to estimate the error in Gaussian quadrature rules. The purpose of the auxiliary measure is to help define an internal quadrature rule with higher degree of algebraic precision than the associated Gaussian rule. NAG quadrature rules are attractive to use for estimating the error in Gaussian rules with respect to the measures when the averaged and generalized averaged Gaussian rules are not internal. An advantage of the NAG rules relative to the corresponding weighted generalized averaged Gaussian quadrature rules is that the algebraic degree of precision of is , while the algebraic degree of precision of the corresponding weighted generalized averaged Gaussian quadrature rules only is ; see [6].
Let , , denote the monic orthogonal polynomials for the measure , and let and be the coefficients of their three-term recurrence relation. It is shown in [6] that the nodes of the NAG quadrature rule are the zeros of the polynomial
Let be the symmetric tridiagonal Jacobi matrix associated with the NAG rule . It has the entries
where we circumscribe the last entries that are determined by the measure by rectangles. The nodes and weights can be conveniently evaluated in arithmetic floating point operations by means of either the Golub–Welsch algorithm or a divide-and-conquer method; see [20,21,27]. The nodes and weights of the Gaussian rule can be determined by applying the Golub–Welsch algorithm or a divide-and-conquer method to the leading principal submatrix of (7). Computed examples reported in [20,21] illustrate that a divide-and-conquer method may yield higher accuracy and require less CPU-time for computing the nodes and weights of the quadrature rules and than available implementations of the Golub–Welsch algorithm.
In this paper, we consider NAG rules with the auxiliary measure chosen to be the Chebyshev measure of the second kind
see [6] [Remark 5.3]. Then, , , The Jacobi matrix (7) is then of the form
The orthogonal polynomials are monic Chebyshev polynomials of the second kind , where
Formula (6) becomes
2. Internality of the Quadrature Rules Determined by Modified Chebyshev Measures of the First Kind
Consider the Chebyshev measure of the first kind,
Then the measure (5) is of the form
We recall some formulas that are discussed by Gautschi [3] [Section 2.4] and in [26]. First note that
so that , when , while , when . Furthermore,
with and . Here, denotes the Chebyshev polynomial of the first kind of degree k defined by
The coefficients of the three-term recursion formula for the polynomials are
Moreover, we have
where
The coefficients of the three-term recurrence relation for the polynomials are given by
For the coefficients , one has
where
We note that is equivalent to , and is equivalent to ; see [26] for details.
The following cases have to be considered:
- , which is equivalent to (); .
- , what is equivalent to (); .
- , what is equivalent to (); .
It is shown in [26] [Theorem 3.2] that the averaged Gaussian quadrature rule has an external node for every , and it is demonstrated in [26] [Theorem 3.3] that the generalized averaged Gaussian quadrature rule is internal if and only if . These properties suggest that NAG rules should be developed for the case . If is internal, then it may be used as an alternative to the quadrature rules and when the integrand is not defined outside the interval .
In order for the largest node of the quadrature rule to be smaller than or equal to 1, it suffices that , i.e., that
Let be the Chebyshev polynomial of the first kind of degree ℓ scaled according to (11). The corresponding monic Chebyshev polynomials satisfy
The monic Chebyshev orthogonal polynomial of the second kind of degree ℓ satisfies
In view of the fact that
and , we obtain by substituting
and
into (16) the inequality
Multiplying this inequality by yields, after simplification,
Finally, dividing the last inequality by gives
where . Since , for , it follows that decreases in . We conclude from , that for . Thus, , when and is constant. This shows that (18) holds for a sufficiently large ℓ, because the term grows the fastest as .
In order for the smallest node of the quadrature rule to be larger than or equal to , it suffices that , i.e.,
Substituting
and , given by (17), into (19), gives the inequality
i.e.,
Multiplying the last inequality by , we obtain
and division by gives
This inequality is satisfied for a sufficiently large ℓ, because the term increases faster than the other terms on the left-hand side in (20) as . We have shown the following result.
Theorem 1.
Let (i.e., (); ). The NAG quadrature rule with respect to the measures and is internal, i.e., all its nodes are in the interval when ℓ is sufficiently large.
3. Internality of the Quadrature Rules Determined by Modified Chebyshev Measures of the Second Kind
We consider the Chebyshev measure of the second kind
Then the measure (5) is of the form
Since the averaged Gaussian quadrature rules and the generalized averaged Gaussian quadrature rules are internal for modified Chebyshev measures of the second kind in (21) for a sufficiently large ℓ, see [26] [Theorem 4.2], there is no reason to use NAG rules for this measure. We therefore omit their analysis.
4. Internality of the Quadrature Rules Determined by Modified Chebyshev Measures of the Third Kind
In this section, we are concerned with the Chebyshev measure of the third kind
The monic orthogonal polynomials with respect to are given by , where is the Chebyshev polynomial of the third kind of degree k scaled so that
Then the measure (5) is of the form
We allow the parameters in (4) to be in the open interval . Note that switching the signs of , and x yields a modification of the Chebyshev measure of the fourth kind,
We review some formulas that are discussed by Gautschi [3] [Section 2.4] and in [26]. Since
we have when , while when .
The monic orthogonal polynomials associated with the measure
are
and the recursion coefficients of the polynomials are given by
For the measure in (23), the orthogonal polynomials and are defined by (12) and (13), respectively. The quotients satisfy the relations
and the coefficients of the three-term recurrence relation for the sequence of orthogonal polynomials are given by (14).
Due to [26] [Theorem 5.3], the generalized averaged Gaussian quadrature rule is internal when ℓ is sufficiently large if and only if , i.e., if and only if . Hence, we can use the quadrature rule to approximate the integral (1) when the integrand only is defined and continuous in the interval . We therefore only analyze the situation when . The following cases have to be considered:
- ; here, .
- ; here, .
- ; here, .
We obtain from [26] [Theorem 5.2] that the averaged Gaussian quadrature rule is internal when ℓ is sufficiently large if and only if . This means that the averaged Gaussian quadrature rule is internal in cases 1 and 2 above, but it is not internal in case 3. Therefore, it may be attractive to apply NAG rules when .
It follows from (9) and the formulas at the beginning of this section that (15) can be expressed as
where is the Chebyshev polynomial of the third kind of degree ℓ introduced above and is the corresponding monic polynomial. We have (see [26])
In order for the largest node of the quadrature rule to be smaller than or equal to 1, it suffices that , i.e., that
Since , we obtain by substituting
and
into (24) the inequality
Multiplying this inequality by gives, after some simplification (see Appendix A),
i.e.,
Let . Dividing inequality (27) by , we obtain
Similarly to the discussion in the previous section, the term is positive (), and it tends to faster than any of the other terms as ℓ increases. We conclude that the last inequality is satisfied for a sufficiently large ℓ.
In order for the smallest node of the quadrature rule to be larger than or equal to , it suffices that , i.e.,
Dividing the above inequality by gives
where
We can see that
where
Since
it follows that the function is decreasing in , and . Moreover,
Therefore,
For , we have
Hence, the function is increasing in and it follows that and
Furthermore,
and
Substituting the last expressions into (28), we obtain
Dividing the above inequality by gives
The last inequality can be expressed as
All terms on the left-hand side of this inequality, except for the ones in the last two rows, tend to zero, when . Since and , the last two terms behave as follows:
Hence, inequality (29) is satisfied for a sufficiently large ℓ. We have shown the following result.
Theorem 2.
The NAG quadrature rule with respect to the measures is internal when ℓ is large enough in the case when (i.e., ) and .
5. Numerical Examples
The numerical examples in this section illustrate applications of the NAG quadrature rules associated with the measures to the estimation of the quadrature error in Gaussian quadrature rules . We approximate the integral (1) for a few integrands and tabulate the error estimate
for several values of ℓ. To illustrate the quality of these estimates, we compare them to error estimates previously used in [26] [Section 6]:
The magnitude of the actual quadrature error, , is denoted by “Error” in the tables. It is computed as , where is a Gauss quadrature rule with a large k. Thus, we approximate the exact value as .
We denote by the averaged Gaussian quadrature rule and by the generalized averaged Gaussian quadrature rule mentioned in this paper. The tables also report results for the weighted averaged quadrature rules and ; these are described in [26]. Furthermore, denotes truncated generalized averaged Gaussian quadrature rules. These are defined in [28]. The weighted and truncated generalized averaged rules were introduced as alternatives to the rules and when the latter rules are not internal. The weighted averaged Gaussian quadrature rules and may then be internal. Also, removing the last rows and columns from the Jacobi matrix of the order associated with the quadrature rule may give an internal quadrature rule, which we denote as . It has the same algebraic degree of precision as . For more details on the construction and properties, including the internality, of the quadrature rules , , and , we refer to [26] and the references therein.
Example 1.
This example is an extension of [26] [Example 6.1]. Let
The true value of the integral is about . Table 8 in [26] reports the error estimates , and for some values of ℓ. Here, we add results for the error estimate . Table 1 displays entries of Table 8 in [26] and also shows the error estimates to allow easy comparison of the estimates. All error estimates can be seen to be very accurate.
Table 1.
Error estimates and the magnitude of the true error for Example 1.
Example 2.
This example is related to Example 6.2 in [26]. Let
The exact value of the integral is about . In this example, the rules , and have a node smaller than . They therefore cannot be used for error estimation. Table 9 in [26] shows the error estimates and for some values of ℓ. We show these estimates in Table 2 as well as error estimates . Since and , it follows from Theorem 1 that the quadrature rule is internal for a sufficiently large ℓ. Numerical computations confirm that the rules are internal for . Figure 1 displays the left-hand sides of inequalities (18) and (20) for the case where and as functions of ℓ, which we denote by , in the interval . The blue curve depicts the function on the left-hand side of inequality (18), and the red curve shows the function on the left-hand side of inequality (20). In this example, the NAG quadrature rules are internal for all .
Table 2.
Error estimates and the magnitude of the true error for Example 2.
We note that the error estimates are more accurate than the error estimates and .
Example 3.
This example is an extension of [26] [Example 6.4]. Let
The true value of the integral is . The rules , , and cannot be evaluated. Table 11 in [26] shows the error estimates and for some ℓ-values. We also show these values in Table 3 to allow easy comparison with the error estimates . As and , it follows from Theorem 2 that the quadrature rule is internal for a sufficiently large ℓ. Numerical computations confirm that the rules are internal for . The nodes and coefficients of the quadrature rule for are reported in Table 4. The error estimate can be seen to be of about the same quality as the error estimate and is more accurate than the estimate .
Table 3.
Error estimates and the magnitude of the true error for Example 3.
Table 4.
The nodes and coefficients of the two-measure-based generalized Gauss quadrature rule, i.e., the NAG quadrature rule, () with respect to the measures , in the case where , and .
The nodes of the two-measure-based generalized Gauss quadrature rule, i.e., the NAG quadrature rule,
with respect to the measure , in the case , and , depend on k. Namely, . Their distribution compared to the corresponding Gaussian rule nodes is displayed in Figure 2 for and in Figure 3 for . We performed many more numerical tests that confirmed the same behavior of the nodes , and observed that . This means that the two-measure-based generalized Gauss quadrature rule, i.e., the NAG quadrature rule, has a similar structure as the averaged , generalized averaged , and weighted averaged , Gaussian quadrature rules, and that only the outermost nodes of , i.e., , may be outside of the interval . It could be of interest to prove this hypothesis. Of course, in this specific case, both of the outermost nodes are internal.
Figure 2.
The distribution nodes of the NAG quadrature rule (marked by red circels) compared to the corresponding Gaussian rule nodes (marked by blue circels), for .
Figure 3.
The distribution nodes of the NAG quadrature rule (marked by red circels) compared to the corresponding Gaussian rule nodes (marked by blue circels), for .
Example 4.
This example is associated with Example 3, only the integrand is different. Let
The true value of the integral is . The rules , , and cannot be evaluated. Table 5 shows the error estimates for some ℓ-values and the actual errors. Numerical computations for this integrand confirm that the error estimate can be seen to be of about the same quality as the error estimate . In this case, the error estimates are a little bit closer to the actual error than the error estimates .
Table 5.
Error estimates and the magnitude of the true error for Example 4.
6. Conclusions
Our interest in modifications of Chebyshev weight functions stems from the attention that modification methods and their applications, e.g., to computing the Hilbert transform, have received in the literature; see Gautschi [3] [Section 2.4] for a thorough discussion of modification algorithms and some applications. This paper analyzes the application of NAG quadrature rules to the estimation of the quadrature error , where is an integral with a modified Chebyshev measure and is the ℓ-node Gauss quadrature rule. Our analysis shows that interior NAG rules can be constructed when averaged or generalized averaged quadrature rules are not interior. The NAG rules therefore can be applied to a larger class of integrands than the averaged and generalized averaged rules. In this paper, these cases are covered by Theorems 1 and 2. For future work, it would be of interest to consider the internality of two-measure-based quadrature rules, i.e., of NAG quadrature rules, for some other measures and their modifications when the auxiliary measure is different from the Chebyshev measure of the second kind.
Author Contributions
Conceptualization, M.M.S.; methodology, D.L.D., L.R. and M.M.S.; software, M.M.S. and S.M.S.; validation, D.L.D., R.M.M.D., A.V.P., L.R. and M.M.S.; formal analysis, L.R. and M.M.S.; investigation, M.M.S. and S.M.S.; writing—original draft preparation, L.R., M.M.S. and S.M.S.; writing—review and editing, D.L.D., R.M.M.D., A.V.P., L.R., M.M.S. and S.M.S.; visualization, S.M.S.; supervision, L.R. and M.M.S. All authors have read and agreed to the published version of the manuscript.
Funding
The research by D.L.D., R.M.M.D., A.V.P., M.M.S. and S.M.S. was supported in part by the Serbian Ministry of Science, Technological Development, and Innovations, according to Contract 451-03-65/2024-03/200105 dated on 5 February 2024.
Data Availability Statement
We have used some data from our research [26]. The data from this research are available on request.
Conflicts of Interest
The authors declare no conflicts of interest.
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