Abstract
Ultra-high-performance concrete with coarse aggregate (UHPC-CA) is a newly developed material. To explore the influence of aggregate volume fraction and maximum aggregate particle size on the compressive strength of UHPC-CA, a batch of UHPC-CA numerical samples as well as some experiments is carried out. The phase-field method is introduced to simulate the uniaxial compressive strength, and the simulation results show good agreement with experimental results. Both the simulation results and experiment results show that the compressive strength decreases with the aggregate volume fraction and increases with the maximum aggregate particle size. A size effect model of UHPC-CA is established by using its aggregate volume fraction and the maximum aggregate particle size.
Keywords
Introduction
Ultra-high-performance concrete (UHPC) is a new generation of concrete developed in the past 30 years (Yoo & Banthia, 2016; Richard and Cheyrezy, 1995), among which the ultra-high-performance concrete with coarse aggregate (UHPC-CA) has a wide application prospect in engineering (Amin et al., 2020; Kim et al., 2018; Li et al., 2021; Zavickis et al., 2020). Adding the coarse aggregates to the UHPC, UHPC-CA has a high economy and environmental protection while only 20% of the compressive strength is lost (Jiang et al., 2019; Teng et al., 2019). However, the coarse aggregates increase the meso-heterogeneity of the material, and the meso-heterogeneity has a pronounced influence on the macroscopic property of concrete (Sahmaran et al., 2009; Wille and Boisvert-Cotulio, 2015; Sobuz et al., 2016). Many experiments were carried out to explore the influence of aggregate on the mechanical property of UHPC-CA.
Reddy and Perumal (2020a, 2020b) put the coarse aggregate with diameters of 6 mm and 10 mm into UHPC. The results show that adding coarse aggregate slightly reduces the mechanical property of UHPC. Li et al. (2019) conducted experiments by controlling the size of coarse aggregates of UHPC-CA and found that when the maximum size of coarse aggregate increases from 8 mm to 25 mm, the reduction of the compressive strength decreases from 14% to 12%. Deng et al. (2020) designed a series of experiments and concluded that adding coarse aggregates increase the bulk density and form a stronger “skeleton,” moreover, compared with UHPC, the elastic modulus of UHPC-CA increases slightly, but the deformability and toughness of UHPC-CA decrease. Huang and Li (2018) studied the influence of the coarse aggregate content and steel bar on the mechanical property of UHPC-CA. The results showed that, with the increase of the coarse aggregate content, the compressive strength of UHPC increases first and then decreases, and the elastic modulus increases almost linearly. Peng et al. (2012,2013) designed a series of experiments to study the high-temperature resistance and explosive peeling behavior of UHPC and UHPC-CA. The results showed that UHPC-CA has better high-temperature resistance than UHPC, and the coarse aggregates have a beneficial effect on reducing explosion spalling of UHPC. Ma et al. (2004) found through experiments that UHPC and UHPC-CA exhibit similar behaviors under compressive stress. The elastic modulus and the peak strain are related to the stiffness of the aggregate used. Besides that, the lower aggregate volume fraction results in a lower auto-shrinkage of UHPC-CA.
In addition to the study of aggregate content, some scholars also focus on the types of coarse aggregates. UHPC-CA with different types of coarse aggregates is designed and tested. For instance, Liu and Wei (2021) used the basalts and the calcined bauxite as coarse aggregates of UHPC-CA. The results showed that UHPC-CA has a lower resistance than UHPC without coarse aggregates. Selecting the basalts with particle sizes of 5–15 mm as coarse aggregate, Lizhi (2020) concluded from a series of experiments that adding aggregates can improve the flexural toughness of UHPC-CA.
Almost all studies show that the addition of coarse aggregates affects the mechanical property of UHPC, but how the coarse aggregates affect the mechanical property is still unclear. For this reason, Lv et al. (2020) discussed the internal mechanism of UHPC-CA through experiments and mercury intrusion scanning and concluded that the type and maximum particle size of coarse aggregate have a significant impact on the workability and mechanical property of UHPC-CA.
Obviously, due to the limitations of experiments in the laboratory, it is not enough to analyze the internal component effects of UHPC-CA only by experimental approaches. Thus, some scholars try to explore the property of UHPC-CA by numerical simulations. Traditional concrete compression failure simulation methods include the element deletion method (Liu et al., 2014; Song et al., 2008), interface element method (Song et al., 2008; Xu and Needleman 1994; Camacho and Ortiz, 1996; Wang et al., 2015), and extended finite element method (XFEM) (Rybczyński et al., 2020). As is known to all, the element deletion method and interface element method have an obvious mesh dependence (Song et al., 2008). The extended finite element method (XFEM) allows the crack to occur within the element (Rybczyński et al., 2020; Zhang and Teng, 2014) so that the entire process of crack propagation can be traced. However, XFEM is difficult to treat the multi-crack problems (Song et al., 2008; Xu and Needleman 1994; Camacho and Ortiz, 1996; Rybczyński et al., 2020; Xu et al., 2014). A large number of complex cracks will produce in the compression test of UHPC-CA. The traditional finite element method cannot well simulate this phenomenon (Liu et al., 2014; Song et al., 2008; Xu and Needleman 1994; Camacho and Ortiz, 1996; Wang et al., 2015; Rybczyński et al., 2020). The phase-field method (Miehe et al., 2010; Wu, 2017; 2020; Bilgen et al., 2019), which has no mesh dependence and excellent performance in crack propagation, is undoubtedly more suitable to simulate the compression of UHPC-CA.
In this paper, the phase-field method is introduced to simulate the uniaxial compressive strength of UHPC-CA. The simulation results are used to establish a size effect model of UHPC-CA in which the relationship between UHPC-CA compressive strength and the aggregates is described.
The outline of the paper is as follows. In the section Model and method, the phase-field method, the random aggregate model of UHPC-CA, and the preparation of experimental samples are introduced. The results of experiments and numerical simulations are shown in the Results section. In the section Discussion, the relationship between UHPC-CA compressive strength and the aggregates is established, and the size effect of UHPC-CA compressive strength is further discussed. The main conclusions are drawn in the section Conclusion.
Model and method
Phase-field method
The phase-field method is a mathematical tool to predict the evolution of the microstructure (Bourdin et al., 2000). The key step of the phase-field fracture simulation is to determine the free energy of the target system and to construct the free energy function of the system. According to the microstructure of the material evolving in the direction of minimizing the free energy, the change of the structure is predicted by the phase-field variables.
The total potential energy of concrete fracture is composed of three parts (Bourdin et al., 2000): volume storage energy, crack surface energy, and external force work
where П is the total fracture potential energy, Y is the surface energy of the crack, U is the volume storage energy, W is the external force work, Gc is the Griffith critical fracture energy constitutive threshold, ψ is the volume storage energy density, V is the accumulated volume, Γ represents for the crack surface, Sσ is the stress boundary, ui is the displacement, Ti is surface forces, and fi is body forces.
Based on the fracture variational theory (Bourdin et al., 2000), a scalar variable ϕ is defined in the interval [0, 1] as the crack phase-field (order parameter). When ϕ = 1, it means that the material is destroyed completely, and when ϕ = 0, it means that the material is intact. The crack surface energy in the form of phase-field can be expressed as
For a two-dimensional problem, the form of the crack surface density function per unit volume is
where l0 is a length scale parameter that controls the crack “diffusion.”
The volumetric storage energy density ψ is determined by the strain tensor εij and the order parameter ϕ
where H(εij) is the elastic strain energy density, Dijkl is the elastic tensor, εij is the strain tensor, and g(ϕ) is the stress degradation function
where k≈10−6 so that the stiffness matrix maintains good non-singularity during a fracture simulation.
To consider both tensile and compression failures of UHPC-CA, a unified phase-field model (Wu et al., 2020) is introduced, in which a modified reference energy y in terms of equivalent effective stress
where y is the elastic strain energy density, E0 is the initial elastic stiffness, the Macaulay brackets <•> are defined as <x> = max{x,0},
From equation (5) and equation (6), the volume storage energy U can be expressed as
When surface forces are not considered, by substituting equation (2), equation (3), and equation (7) into equation (1), the total fracture potential energy can be expressed as
The first-order variation of the total fracture potential energy is
where nj is the direction cosine of the outer normal of the boundary ∂V, σij =[(1–ϕ)2+k] •Dijkl•εkl,
Fracture variational theory believes that any dynamic growth state of cracks at any position should minimize the total potential energy. That is, δП = 0 holds for any δui and δϕ in equilibrium, the governing equation of the fracture problem is calculated by equation (9)
The phase-field evolution equation of the fracture problem is
The boundary conditions of force are
The natural boundary conditions of the phase-field are
The phase-field fracture variational theory inherits and develops the traditional Griffith theory, and solves the problems of crack initiation, propagation path, and instability bifurcation that cannot be solved by Griffith theory, providing a new perspective for the study of fracture problems.
The phase-field simulation is performed through the secondary development of commercial software. In addition to the two degrees of freedom of displacement, a phase-field degree of freedom is added in FEM (Miehe et al., 2010).
Numerical samples
A two-dimensional model is established, in which UHPC-CA is considered to be a three-phase composite material composed of aggregate, cementitious paste, and interfacial transition zone (ITZ). Both the length and width of the UHPC-CA numerical sample are set as L = 100 mm, and the coarse aggregate is assumed to be round. The uniform horizontal compressive stress q is distributed on the top boundary, the type of load is displacement loading and the total displacement loading is set as 0.6 mm, and the loading step is set as 100. The geometric shape and boundary conditions of the numerical model are shown in Figure 1(a).

Numerical sample: (a) Geometry and boundary conditions, (b) mesh of the model.
The diameter of the coarse aggregate (ϕ) are set as ϕ1 = 4 mm, ϕ2 = 8 mm, ϕ3 = 13 mm and ϕ4 = 16 mm respectively. The Monte Carlo method is used to generate the random aggregate model of UHPC-CA, and the number of the aggregate of different sizes is determined according to the actual mix proportion. A four-node plane strain square element is used to mesh the UHPC-CA numerical model. There are three types of elements: aggregate element, cementitious paste element, and ITZ element. To reduce the influence of network density, all samples are divided into 320 × 320 elements, and all elements have the same size, as shown in Figure 1(b). To simplify the model, and considering that the main analysis objective is the compressive strength fc which is little affected by steel fibers, so the samples prepared in this article are not mixed with steel fibers.
To explore the influence of the aggregate volume fraction (P) and gradation (G) of the coarse aggregate in UHPC-CA samples on its compressive strength, a batch of UHPC-CA numerical samples with different P and G are prepared. There are four types of G, as shown in Table 1.
Size and gradations of coarse aggregates.
An orthogonal experiment is designed, as shown in Figure 2. The aggregate volume fraction P of the orthogonal experiments ranges from 20% to 40% and the gradation G of the orthogonal experiments ranges from G1 (ϕ1) to G4 (ϕ1+ϕ2+ϕ3+ϕ4). The detailed parameters are shown in Table 2.

Numerical samples of different P and G.
Summary of numerical samples.
Experimental samples
To verify the numerical model, a comparative physical experiment is designed for the numerical model with an aggregate volume fraction of 30% or a gradation of G3. Among them, the composition of UHPC-CA is shown in Table 3, and frosted glass beads with the same particle size as the numerical experiment are used as the coarse aggregate. For each numerical sample, three comparative experimental samples are set. In addition to the above samples, three samples without coarse aggregate (UHPC-NCA) are also prepared to obtain the material parameters of the concrete. All the experimental samples are listed in Table 4.
Composition of UHPC-CA.
Summary of experimental samples.
Some of the prepared samples are shown in Figure 3(a). A uniaxial compression test is carried out on this batch of samples. The experiment adopts displacement-based loading the same as numerical simulation, the total load is set to 0.6 mm, and the load is completed in 100 steps. The specific experimental setup is shown in Figure 3(b).

Uniaxial compression tests of UHPC-CA: (a) Samples of UHPC-CA, (b) test setup.
Numerical parameters
The elastic modulus of the cementitious paste is calculated from the uniaxial compression test results of the UHPC-NCA sample prepared in the section Experimental samples. The stress–strain curves of the UHPC-NCA sample are shown in Figure 4. The modulus of elasticity is calculated as follows (Bujnakova et al., 2019)
where, σA and εA are the stress and strain of point A in Figure 4, σB and εB are the stress and strain of point B in Figure 4, point A and point B should be before 1/3 ultimate strain of the stress-strain curve (Bujnakova et al., 2019).

Average stress–strain curve of UHPC sample in a uniaxial compression test.
The Poisson’s ratio of cementitious paste is set as 0.2, and the phase-field parameters Gc of cementitious paste is set as 49.34 Pa·m−1 (Wu et al., 2020). The corsage aggregate used in the experiment is ground glass beads, of which the Poisson’s ratio and the elastic modulus are supported by the manufacturer and be set as 0.25 and 80 GPa. The Gc of corsage aggregate is set to 144.00 Pa·m−1. The elastic modulus and Gc of ITZ are determined through a series of numerical simulations based on the shooting method and be set as 22.6 Gpa and 18.10 Pa·m−1 (Kotova et al., 2021), Poisson’s ratio is the same as cement. l0 is related to the crack width of the material failure (Wu & Nguyen, 2018). Several numerical simulations are carried out and when l0 of the three materials are taken as 0.0015 m, 0.001 m and 0.0008 m, the cracks shown by the numerical model are consistent with the experiments. All material parameters are summarized in Table 5.
Material parameters and phase-field parameters in numerical samples.
Results
Compare of experiment and numerical simulation
The results of an experimental sample (Pf30-G3) under the uniaxial compression are shown in Figure 5. The evolution simulated for a typical numerical sample of Pf30-G3 is illustrated in Figure 6. Comparing the experimental results with the numerical results, it is not difficult to see that the crack positions are all consistent, and the cracks generally occur first in the ITZ between the cementitious paste and the coarse aggregate, and gradually spread along the gap between the particles.

Typical results of an experimental sample (Pf30-G3) under the uniaxial compression.

Typical results of a numerical sample (φ = 0 means the material is intact, φ = 1 means completely destroyed): (a) Displacement load u = 0 mm, (b) u = 0.270 mm, (c) u = 0.324 mm, (d) u = 0.384 mm, (e) u = 0.402 mm, (f) u = 0.414 mm, (g) u = 0.432 mm, (h) u = 0.600 mm.
Extensive Monte Carlo simulations of numerical samples of different P and G (P = 20%–40%, G = G1∼G4, see Figure 2) with different aggregates distribution were carried out. The samples have the same aggregate volume fraction and aggregate gradation, but different aggregate distribution locations (Figures 1 and 2). For each type of UHPC-CA, 50 samples were modeled to ensure that the results are statistical convergence (Figure 7). The mean compressive strength of the UHPC-CA model for each P and G was obtained by averaging the Monte Carlo simulation results (Rybczyński et al., 2020).

Samples of Monte Carlo simulation (take Pf30-G3 as an example).
The stress–strain curves of the experiment and numerical simulation with the mean curve are shown in Figure 8 (taking Pf30-G3 as an example). The mean compressive strength is compared with experimental strength, as shown in Table 6. The physical experiment was only carried out for aggregate volume fraction of 30% and aggregate gradation of G3, while the numerical experiments are carried out for the models of all gradations and all aggregate volume fractions.

Results of the experiment and Monte Carlo simulation (taking Pf30-G3 as an example).
Compressive strength of simulation and experiment.
It can be seen from Figure 8 that the stress–strain curve obtained from the experiment is within the stress–strain curve domain of 50 kinds of numerical simulations. In the ascending and descending sections of the stress–strain curve, the experiment and numerical simulation are similar. At the end of the stress–strain curve, the experiment results show that the samples still have residual stress, while the numerical simulation result shows that the stress is zero. This may be because the elements of the phase-field method will lose all the bearing capacity after failure.
The mean compressive strength of the Monte Carlo numerical simulation is compared with the experimental compressive strength fc in Table 6. It can be seen that the average error between the results of the numerical simulation and the experiment is 1.47%. It is small enough to prove that the results of our numerical simulation are credible.
Influence of aggregate volume fraction and gradation
Based on the numerical simulation results in 3.1, the influences of P and G on the compressive strength of UHPC-CA are explored in this section.
Influence of aggregate volume fraction P
The mean stress–strain curves of UHPC-CA samples with different P and same G are compared in Figure 9. The compressive strength fc of different P is compared in Figure 10. It can be seen that the uniaxial compressive strength of concrete decreases linearly with the aggregate volume fraction P. It is consistent with experimental observations, as shown in Table 6.

Influence of aggregate volume fraction on the uniaxial compression compressive strength of UHPC-CA: (a) mean stress-strain curves of G1, (b) mean stress–strain curves of G2, (c) mean stress–strain curves of G3, (d) mean stress–strain curves of G4.

Fitting curve of compressive strength with aggregate volume fraction.
The reason for this phenomenon may be that the addition of coarse aggregate causes defects in the ITZ of UHPC-CA, and the increase of defects leads to the weakening of the compressive strength of UHPC-CA.
In addition, although coarse aggregate has a higher modulus of elasticity, and has a strengthening effect on the elastic modulus of UHPC, the addition of coarse aggregate also causes the increase in the ITZ, which has a greater impact on the modulus of UHPC-CA. Therefore, the addition of coarse aggregate will reduce the elastic modulus of UHPC-CA.
It can be seen from Figure 10 that the trend of compressive strength fc with aggregate volume fraction P is an approximately linear negative correlation. The fitting curve between fc and P is drawn in Figure 10. For the same G, the fitting expression is as follows
where Af and Bf are fitting parameters and are shown in Table 7, fc is the uniaxial compressive strength of the UHPC-CA samples.
Fitting parameters.
It can be seen from Table 7 that the slopes of several fitting curves are relatively close but the intercepts are different. It can be considered that the Bf is a constant and the Af decreases with G. It can be concluded that adding aggregate decreases the compressive strength of UHPC-CA.
Influence of aggregate gradation G
For UHPC-CA samples with the same aggregate volume fraction P, the maximum aggregate particle size (ϕm) increases with the aggregate gradation G, as shown in Table 1. In this paper, the relationship between ϕm and fc is discussed to reveal the influence of aggregate gradation G on the fc of UHPC-CA.
For each group of UHPC-CA numerical models with the same P and different G, the uniaxial compression stress-strain curves are shown in Figure 11. The fc of different ϕm is compared in Figure 12(a). It can be seen from Figure 11 that the elastic modulus (slopes of ascending sections of the curve) increases with the G. Also, it can be seen from Figure 12(a) that fc increases with ϕm.

Influence of aggregate gradation on the uniaxial compression compressive strength of UHPC-CA: (a) mean stress-strain curves of P = 20%, (b) mean stress–strain curves of P = 25%, (c) mean stress–strain curves of P = 30%, (d) mean stress–strain curves of P = 35%, (e) mean stress–strain curves of P = 40%.

Relationship between the compressive strength and the ϕm: (a) compressive strength with ϕm, (b) fitting curve of compressive strength with 1/ϕm.
It is not difficult to see from Figure 12(a) that the uniaxial compressive strength of the UHPC-CA sample is positively correlated with the ϕm, and the curve of UHPC-CA uniaxial compressive strength and 1/ϕm is fitted as shown in Figure 12(b). The fitting relationship can be described as
where Cf and Df are fitting parameters and are shown in Table 8.
Fitting parameters.
It can be seen from Table 8 that Df is approximate a constant, and Cf is a value related to P. To obtain a unified fc expression, the relationship between Cf and P is fitted to Figure 13(b), and for the section Influence of aggregate volume fraction P, the relationship between Af and ϕm is fitted in Figure 13(a).

Relationship between the fitting parameter and the aggregate: (a) Cf and P (b) Af and ϕm.
The fitting relationship is as follows
where
By coalesce equation (15), equation (16), and equation (17), it is not difficult to get a unified formula
where pf, qf, and wf is the fitting parameter related to Bf, Df,
So far, the uniaxial compressive strength can be predicted by its aggregate volume fraction and the maximum aggregate particle size. It can be concluded that when P is constant, a reasonable aggregate gradation can significantly improve the compressive strength of UHPC-CA.
Discussion
In this section, the phase-field model of UHPC-CA which is proposed in this paper is verified by discussing the size effect of UHPC-CA. Based on the UHPC-CA numerical model given in Sect. 2, a series of uniaxial compression numerical samples of UHPC-CA with the side length from 25 mm to 200 mm (as shown in Figure 14) are used to simulate the size effect of UHPC-CA. To ensure the same aggregate volume fraction of the samples of various sizes, the aggregate volume fraction of the samples is 30%, and the G is set as G1 (ϕm = 2 mm).

UHPC-CA samples of different sizes (take Pf30-G1 as an example): (a) L = 25 mm, (b) L = 50 mm, (c) L = 75 mm, (d) L = 100 mm, (e) L = 125 mm, (f) L = 150 mm, (g) L = 175 mm, (h) L = 200 mm.
The stress–strain curves of these samples are shown in Figure 15(a); the fitting curve of
where the fitting parameters λ = 0.9825 and μ = 0.01639, and the adjusted coefficient of determination (adj. R-square) equal to 0.98275, as shown in Figure 15(b).

Numerical simulation results of UHPC-CA different sizes (P = 30%, G = G1, ϕm = 2 mm): (a) Stress–strain curves, (b) fitting curve of
The substitution of equation (18) into equation (19) yields
It can be seen from equation (20) that the compressive strength of UHPC-CA sample with side length L can be predicted by the aggregate volume fraction (P), the maximum aggregate particle size (ϕm) of UHPC-CA sample, and the compressive strength of UHPC-CA sample with a side length of 100 mm.
In spite that equation (20) is derived from the samples of P = 30% and ϕm = 2 mm, equation (20) can be used in the samples with different side lengths, different aggregate volume fraction, and different maximum aggregate particle sizes. Some numerical samples of UHPC-CA with different parameters are established to verify the expression. The compressive strength of these samples is calculated by numerical simulation and equation (20), as shown in Table 9.
Compare of compressive strength calculated by numerical simulation and equation (20).
It can be seen from Table 9 that the error of the compressive strength of these different samples is about 1%. It can be concluded that the size effect can be described by the phase-field model of UHPC-CA proposed in this paper. The phase-field model of this paper has sufficient precision.
Conclusion
The compressive strength of UHPC-CA is studied by the phase-field method and the uniaxial compression testing. The Monte Carlo simulation of UHPC-CA shows that the distribution of the aggregates has little influence on the compressive strength of UHPC-CA. The effects of the volume fraction and particle size of the coarse aggregate on the compressive strength of UHPC-CA are investigated. Both the experiment and simulation results show that the compressive strength decreases with the aggregate volume fraction, and increases with the maximum aggregate particle size. A size effect model of UHPC-CA is established to describe the relationship between the UHPC-CA compressive strength and the volume fraction and particle size of the coarse aggregate. For a UHPC-CA sample, adding coarse aggregates decrease the compressive strength, but a reasonable aggregate gradation can help reduce this decrease.
Footnotes
Declaration of conflicting interests
The author(s) declared no potential conflicts of interest with respect to the research, authorship, and/or publication of this article.
Funding
The author(s) received no financial support for the research, authorship, and/or publication of this article.
