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DOE OSTI2021

Simulation of hardened cement degradation and estimation of uncertainty in predicted failure times with peridynamics

Modeling the degradation of cement-based infrastructure due to aqueous environmental conditions continues to be a challenge. In order to develop a capability to predict concrete infrastructure failure due to chemical degradation, here we created a chemomechanical model of the effects of long-term water exposure on cement paste. The model couples the mechanical static equilibrium balance with reactive–diffusive transport and incorporates fracture and failure via peridynamics (a meshless simulation method). The model includes fundamental aspects of degradation of ordinary Portland cement (OPC) paste, including the observed softening, reduced toughness, and shrinkage of the cement paste, and increased reactivity and transport with water induced degradation. This version of the model focuses on the first stage of cement paste decalcification, the dissolution of portlandite. Given unknowns in the cement paste degradation process and the cost of uncertainty quantification (UQ), we adopt a minimally complex model in two dimensions (2D) in order to perform sensitivity analysis and UQ. We calibrate the model to existing experimental data using simulations of common tests such as flexure, compression and diffusion. Then we calculate the global sensitivity and uncertainty of predicted failure times based on variation of eleven unique and fundamental material properties. We observed particularly strong sensitivities to the diffusion coefficient, the reaction rate, and the shrinkage with degradation. Also, the predicted time of first fracture is highly correlated with the time to total failure in compression, which implies fracture can indicate impending degradation induced failure; however, the distributions of the two events overlap so the lead time may be minimal. Extension of the model to include the multiple reactions that describe complete degradation, viscous relaxation, post-peak load mechanisms, and to three dimensions to explore the interactions of complex fracture patterns evoked by more realistic geometry is straightforward and ongoing.

36 MATERIALS SCIENCE↗

DOE OSTI2024

Retrofitting Holcim Ste. Genevieve Cement Plant with CO2 Capture Plant Using Air Liquide Cryocap™ FG Technology

The global cement manufacturing industry is a major contributor to carbon dioxide emissions. The International Energy Agency's "Net Zero Emissions by 2050 Scenario" identifies CCS as a major strategy for meeting that goal. This project is among the first attempts to transfer capture technology developed at coal-fired power plants to the cement industry. The main objective of the project is to execute and complete a front-end engineering and design (FEED) studies for commercial-scale, carbon capture projects that separates 95% of the total CO2 emissions at the Holcim (US) Ste. Genevieve cement manufacturing facility using Air Liquide’s Pressure Swing Adsorption system (PSA) assisted Cryocap™ technology. The Holcim Ste. Genevieve cement plant in Missouri, US, boasts one of the largest single cement production lines in the world, with a capacity of approximately 12,000 t/day. The plant currently uses traditional fuels, namely coal and petcoke. The captured CO2 will be pipeline and geological storage grade. The industrial host site emits approximately 3.0 million tonne CO2/yr. Air Liquide’s Cryocap™ technology has been developed over the last 18+ years for CO2 capture applications. It has been shown to be applicable to a variety of industrial applications (e.g., steel, cement, SMR, Fluidized Catalytic Crackers (FCCs)). Cryocap™ FG consists of a Pressure Swing Adsorption (PSA) unit coupled with a Cryogenic System. The PSA pre-concentrates the CO2 from the flue gas, while the cryogenic unit enables the CO2 purity to be increased to the desired level. The project team is led by the Prairie Research Institute at the University of Illinois at Urbana-Champaign. The tasks include: complete FEED study for retrofitting the industrial facility with a carbon capture system to support developing a detailed cost estimate; business case analysis outlining the anticipated revenue and credits if projects was built and operated; technoeconomic analysis (TEA) outlining how capture system achieves DOE capture goals; and life cycle (LCA) analysis demonstrating zero net carbon emissions. The FEED study was successfully completed. This includes completing the process basis of design; preliminary engineering; outside battery limits (OSBL) detailed engineering including a Zero Liquid Discharge (ZLD) wastewater treatment system; inside battery limits (ISBL) detailed engineering [1]. An overall project capital cost estimate within a -20%/+30% accuracy was developed. The major contributors to the Total Plant Cost (TPC), by system, are the costs associated with the Outside Battery Limit (OSBL) section of the plant which includes a new river water intake structure and a Zero Liquid Discharge (ZLD) system. By cost category, the major contributors to the TPC are equipment and subcontractor costs, followed closely by engineering, construction management, home office and contractor fees. The TEA has been created to reflect the findings of the project. It analyzes the economic performance of the Cryocap™ technology by reviewing the estimated capital costs, operating cost, and revenue. The Cost of Capture (COC) associated with the Cryocap™ technology for 95% CO2 capture, when considering NETL 2018 economic assumptions (42/58 debt/equity ratio, 5.15% interest on debt and 1.42% return on equity in real dollars) and 2022 economic assumptions (42/58 debt/equity ratio, 8.82% interest on debt and 4.90% return on equity in real dollars) was found to be much lower than that for the DOE-NETL’s base-line cases. The highest contributors to the COC are annualized capital expenditures (CAPEX) and electricity consumption which can be offset by using lower cost renewable sources. The LCA was conducted using OpenLCA which is an open-source software that is recommended by NETL. The database utilized for this study was a modified version of TRACI 2.1 (developed by the US. Environmental Protection Agency’s National Risk Management Research Laboratory and modified by NETL). The Cryocap™ FG technology does not consume fuels in significant quantities and does not utilize specialized chemical solvents subject to decomposition, such as those utilized in amine-based carbon capture systems. The Cryocap™ FG technology mainly utilizes electricity as its energy input; hence, its calculated emissions are mainly associated with the generation of electricity offsite and are dependent on the energy matrix of the grid at the time of project implementation. The water consumption impact of the Cryocap™ FG is mostly for makeup of the water lost by evaporation in the cooling tower; however, the carbon capture plant will be equipped with a ZLD system to avoid effluent streams and minimize water consumption. The successful construction and operation of this plant based on this study results will provide a means to demonstrate an economically attractive and transformational capture technology that can be used to retrofit existing plants and be deployed at new plants.

01 COAL, LIGNITE, AND PEAT↗

DOE OSTI2021

Calcium Carbonate Cement: A Carbon Capture, Utilization, and Storage (CCUS) Technique

A novel calcium carbonate cement system that mimics the naturally occurring mineralization process of carbon dioxide to biogenic or geologic calcium carbonate deposits was developed utilizing carbon dioxide-containing flue gas and high-calcium industrial solid waste as raw materials. The calcium carbonate cement reaction is based on the polymorphic transformation from metastable vaterite to aragonite and can achieve >40 MPa compressive strength. Due to its unique properties, the calcium carbonate cement is well suited for building materials applications with controlled factory manufacturing processes that can take advantage of its rapid curing at elevated temperatures and lower density for competitive advantages. Examples of suitable applications are lightweight fiber cement board and aerated concrete. The new cement system described is an environmentally sustainable alternative cement that can be carbon negative, meaning more carbon dioxide is captured during its manufacture than is emitted.

36 MATERIALS SCIENCE↗

DOE OSTI2026

State of Innovation 2025: Progress in Accelerating Next-Generation Cement and Concrete Technologies

The cement and concrete sectors are entering a decisive period as next-generation technologies advance from laboratory research to demonstration, early deployment, and first-of-a-kind commercial plants. Building on the 2024 State of Innovation report, the 2025 outlook highlights both the rapid acceleration of innovation and the urgent need for coordinated action across the value chain. Venture capital activity into the cement and concrete space stabilized following the record surge of 2022-2023, yet landmark financings, such as Sublime Systems' $200 million round and Terra CO2's $124 million Series B, signal continued investor confidence in companies approaching commercialization. Corporate procurement has become a powerful new catalyst, with Microsoft, Amazon, and CRH (Cement Roadstone Holdings) Ventures providing long-term commitments that underpin the first wave of next-generation cementitious products. The sector is shifting from early-stage experimentation toward the scaling of well-capitalized leaders capable of bridging the critical "capitalization gap." Early innovators continue to expand the toolkit through novel binders, electrochemical cements, biogenic limestone, and carbonate mineralization pathways. Going into 2026, cost competitiveness, durability validation, and scalability enabled by resilient supply chains remain the decisive factors for market adoption. At the 2025 Next Generation Cement and Concrete Critical Technologies Meeting, attendees emphasized dual-track funding strategies that integrate federal grants with private capital as key to enabling market breakthrough. State programs and corporate demand are sustaining momentum, while successful companies increasingly demonstrate both economic value and reduced dependence on imported materials. The National Concrete Pavement Technology Center and others underscored that broad integration of next-generation materials will hinge on standards compatibility, verified field performance, and workforce readiness. Colorado continues to serve as a proving ground through pilot programs that combine supplier training, phased implementation, and real-world data to de-risk innovation and provide replicable models for other regions. The 2025 Cement and Concrete Critical Technologies Workshop reinforced that scaling next-generation materials will require alignment among technology innovation, performance validation, and market demand. Stakeholders must move beyond siloed efforts toward collaborative frameworks that coordinate standards, funding, and infrastructure deployment. As a neutral convener and technical validator, the National Laboratory of the Rockies (NLR) plays a pivotal role in bridging innovation and market adoption through collaborative research, technology validation, and entrepreneurship programs. By uniting innovators, incumbents, policymakers, contractors, and investors, NLR and its partners are helping chart a credible pathway toward widespread commercialization in the decade ahead.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

DOE OSTI2021

Rheology of fresh cement pastes containing polymer nanoparticles

Influences of polymer nanoparticles (PNPs) with varied charge densities on the rheological behaviors of fresh cement pastes (fcps) without and with polycarboxylate superplasticizer (PCE) were studied. In the blank fcp, the addition of PCE and highly anionically charged PNPs greatly decreases the yield stress and the plastic viscosity due to their large adsorption on cement that produces electrostatic repulsion and steric hindrance between cement grains. However, the non-adsorbing nonionic PNPs show a slightly opposite effect. In the PCE-containing fcp, both the anionic and nonionic PNPs become non-adsorbing on cement due to the stronger affinity of PCE to cement surface. In this way, the addition of the PNPs in the PCE-containing fcp slightly increases the yield stress and the plastic viscosity, but significantly decreases the pseudoplastic index, which is believed to result from the generation of the so-called depletion attractive force between cement grains induced by the non-adsorbing polymers.

36 MATERIALS SCIENCE↗

DOE OSTI2021

Formulation of low clinker blended cements and concrete with enhanced fresh and hardened properties

Blended cements appear as the most promising way to massively produce cements with reduced environmental footprints. However, considering the generally lower early mechanical performance of highly blended cements, chemical admixtures are increasingly relied upon to increase early strength. However, in many cases this can negatively impact other properties as rheology and durability. This paper proposes an approach to formulate low clinker cements and concrete using moderate alkali activation or gypsum to enhance early and long-term compressive strength, without inducing excessive alkali-silica reaction (ASR) expansion. It examines blended cements containing burnt oil shale along with limestone and fly ash or slag as supplementary cementitious materials. It optimizes the combination of polycarboxylate ether (PCE) superplasticizers with the strength enhancers. Along with the use of Ca(NO{sub 3}){sub 2} to drive PCE adsorption, this provides good rheology control, increased early and long-term compressive strength, as well as acceptable ASR expansion in cements with only 50% clinker.

36 MATERIALS SCIENCE↗

DOE OSTI2018

Theoretical investigation of C-(A)-S-H(I) cement hydrates

The atomic-level understanding of the correlation of chemical, electronic and bonding behavior to mechanical properties of complex multi-component calcium (alumino)silicate hydrates [C-(A)-S-H] (The Cement Chemist Notation heavily used in this manuscript refers to C=CaO; A=Al 2 O 3 ; S=SiO 2 ; H=H 2 O or –OH), which is among the main binding phases of concrete could provide a point of departure for the study of cement behavior. In this paper, models of highly ordered C-(A)-S-H(I) are proposed and investigated. These models have been optimized and constructed in close relation and guidance of relevant experiments. The focus of the work is on illuminating the effect of Al substitution on chemical and mechanical properties of highly ordered synthetic cement phases. Furthermore, we show the importance of hydrogen bonds to mechanical properties in cements. We show, for the first time, that in the absence of vacancies in Dreierketten chains, the Al substitution in bridging sites reduces the mechanical anisotropy of C-(A)-S-H(I) cement. The study also shows the average partial charge of O, H, Si of different structural units are effectively independent of the chemical environment. This finding could have profound implications upon relevant classical molecular dynamics force fields for cements and could lead to further improvements in the modeling capabilities.

36 MATERIALS SCIENCE↗

DOE OSTI2018

Oxygen Isotope Microanalysis By Secondary Ion Mass Spectrometry Suggests Continuous 300-million-year History of Calcite Cementation and Dolomitization in the Devonian Bakken Formation

Calcite cementation and dolomitization are key diagenetic processes in many sedimentary systems. Unravelling detailed histories and timescales of cementation and replacement is, however, often compromised by the limited spatial resolution of many analytical techniques; in some cases multiple grains are co-analyzed so that diagenetic histories are blurred and reaction periods are difficult to establish. In this study we have used 10-micrometer-resolution, in situ secondary ion mass spectrometry to determine the oxygen isotope composition of 197 individual, 10–50-micrometer-size crystals of dolomite and calcite from six samples in a single core of Upper Devonian middle Bakken Member siltstones and sandstones, the major tight oil formation of the Williston basin, USA. This amount of data places important constraints on the range of temperatures and times that carbonate cementation and replacement occurred. Petrographic data show that microcrystalline calcite cement is an early phase, and combined with mineralogical data suggest that much of the dolomite replaces calcite. Over spatial scales of less than a centimeter, analyses of individual calcite crystals have a range of 5‰ for δ 18 O in the group of crystals, and for the group of individual dolomite crystals, 10‰. These sub-centimeter ranges are as great as those observed in previous studies of carbonate cements sampled over many meters and remind us that previous low-resolution studies may have inadvertently analyzed mixed phases. There is no relationship between dolomite texture and isotopic composition at this spatial scale; microscale backscattered electron imagery and scanning electron microscopy cathodoluminescence zoning is seen, but cannot be resolved with a 10-micrometer spot size. Assuming, since it is an early cement, that calcite precipitated from seawater (δ 18 O = –1.5‰), it formed at ca. 15–40°C, mainly at the lower temperatures. Present-day formation waters in Devonian rocks in this region have oxygen isotope compositions of 7–8‰ VSMOW. Using these values as a likely dolomitizing fluid, we suggest that dolomitization occurred continuously between 40 and 140°C over 150–200 million years, most likely in a fluid with a high Mg/Ca ratio resulting from gypsum formation in local evaporites. Finally, we suggest that this exceptionally low rate of dolomitization was controlled by the low rate of supply of Mg in a very sluggish flow regime; dolomitization is incomplete because of a limited supply of Mg.

58 GEOSCIENCES↗

DOE OSTI2019

Self-Healing, Re-adhering, and Corrosion-Mitigating Inorganic Cement Composites for Geothermal Wells at 270°-300°C: Final Report

Under the DOE EERE Geothermal Technologies Office (GTO)-funding project in FY 2016- 2018, the scope of work at Brookhaven National Laboratory (BNL) aimed 1) to conduct the screening of qualified candidates for self-healing cement composites reinforced with microcarbon fiber (MCF), 2) to obtain the fundamental understanding of self-healing mechanism, to develop self-healing aides, 3) to evaluate re-adhering performance of debonded self-healing composites to carbon steel (CS) casing or granite rock formation, 4) to evaluate bond durability of composite/CS joint in acid and thermal shock environments, 5) to assess the corrosion mitigation of CS by composites adhering and re-adhering to CS surfaces, and 6) to investigate the maintenance of pumpability at 85° and 100°C of optimized composite slurry as well as to evaluate self-healing and re-adhering ability of pumpable composite formulation at hydrothermal temperatures, ranging from 270° to 300°C. In this work, three different cementitious material groups, 1) Ordinary Portland Cement (OPC)-based cements, 2) alkali (sodium metasilicate, SMS)-activated cements, and 3) phosphate (sodium hexametaphosphate, SHMP)-bonded cements, were evaluated to meet the following ten material criteria suitable for inorganic cement composites in six different environments, the plain water, alkali carbonate, geo-brine, thermal shock, pH 0.6 H 2 SO 4 /brine, and pH 5.5 scCO 2 /brine.

15 GEOTHERMAL ENERGY↗

DOE OSTI2023

Analysis of Carbon Capture Retrofits for Cement Plants

The objective of this study is to provide an estimate of the cost to capture CO 2 in retrofit applications at cement plants. The cement plant configurations considered in this study include natural gas and solid fuel (coal and coke) cases, and both wet- and dry kiln-fed plant designs, however the base cement plants in this study were not evaluated other than characterization of their kiln off-gas stream and high-level quantification of heat integration potential at the existing plant. In each case, the base cement plant produces 1.5 M tonnes per year of finished cement, assuming 91.4 percent clinker content. This analysis includes a 10 percent retrofit cost increase for process integration and low grade heat recovery, when compared to the analogous non-heat integration case. Heat integration is considered as a potential offset to capture system heating demands (i.e., as a percentage reduction). Recovery and reuse of excess heat from the base cement plant can provide economic benefits—primarily by reducing the need to purchase supplemental natural gas for CO 2 solvent regeneration—but any process improvement must be great enough to overcome the cost increases (i.e., capital and O&M) necessary to realize those benefits. With heat integration potential of 10 percent and 30 percent, that benefit wasn’t significant enough to offset the increase in capital and operating costs, and a cost of capture increase was observed based on the assumptions in this report. Benefits of heat integration potential may be realized when natural gas prices are higher, as demonstrated in the sensitivity to natural gas price where crossover points exist between heat integration cases and their respective non-heat integration cases. Four of the base cases were further evaluated to explore the cost implications of deeper levels of gas pre-treatment to remove oxides of nitrogen (NOx) and oxides of sulfur (SOx) from the kiln off-gas stream prior to CO 2 capture, purification, and compression. The results of these additional case analyses showed a 7.4–18.8 percent increase in cost of capture over the respective base case (i.e., analogous cases without SOx/NOx removal).

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

NASA NTRS1982

An assessment of gas-side fouling in cement plants

The cement industry is the most energy-intensive industry in the United States in terms of energy cost as a percentage of the total product cost. An assessment of gas-side fouling in cement plants with special emphasis on heat recovery applications is provided. In the present context, fouling is defined as the buildup of scale on a heat-transfer surface which retards the transfer of heat and includes the related problems of erosion and corrosion. Exhaust gases in the cement industry which are suitable for heat recovery range in temperature from about 100 to 1300 K, are generally dusty, may be highly abrasive, and are often heavily laden with alkalies, sulfates, and chlorides. Particulates in the exhaust streams range in size from molecular to about 100 micrometers in diameter and come from both the raw feed as well as the ash in the coal which is the primary fuel used in the cement industry. The major types of heat-transfer equipment used in the cement industry include preheaters, gas-to-air heat exchangers, waste heat boilers, and clinker coolers. At the present time, the trend in this country is toward suspension preheater systems, in which the raw feed is heated by direct contact with the hot kiln exit gases, and away from waste heat boilers as the principal method of heat recovery. The most important gas-side fouling mechanisms in the cement industry are those due to particulate, chemical reaction, and corrosion fouling.

Marner, W. J.↗

NASA NTRS2019

Experimental Investigation of Cement Hydration in Gravity-Free Environment

In this work, cement hydration in terrestrial and microgravity environment was compared. This was for the first time, when the International Space Station was utilized to fully investigate the complex process of cement solidification. Microstructural development of hydrating cement occurs in stages during the hydration reaction and hardening process, which results in elaborate combinations of amorphous and crystalline phases. The morphology, volume fraction, and distribution of these phases ultimately determine the hardened cement’s material properties. Minimizing gravity-driven phenomena, such as thermosolutal convective flow and sedimentation ensures crystal growth strictly by diffusion and a microstructure forms differently from that observed in typical laboratory conditions on Earth. A test matrix was developed that includes samples with various w/c ratio and various compositions; incorporating alite, pure water and cement system, cement with chemical admixtures, as well as commercial products. This paper reports on main changes initially observed in the microstructural development of hydrated pure compound of tricalcium silicate (C3S).

Neves, Juliana↗

DOE OSTI2021

Self-re-adhering alkali-activated cement composite and its ability to mitigate corrosion of carbon steel in 300 °C hydrothermal environment

Cement-steel interface is a weak point of cement sheath integrity under the environments of high-temperature geothermal wells. This paper presents carbon steel (CS) adherence behaviors of 300 °C-autoclaved alkali-activated Calcium-Aluminate-Cement (CAC)/fly ash F (FAF) (Thermal Shock Resistant Cement, TSRC), granulated blast furnace slag (GBFS)/SiO 2 , and Ordinary Portland Cement (OPC)/SiO 2 blends. The composites’ ability to preserve the bond under the conditions of thermal shock (TS) and strong acid attack (pH 0.6 H 2 SO 4 /brine at 90 °C) as well as their ability to recover the damaged bond and provide steel corrosion protection after additional short-time 5-day curing at 300 °C were evaluated. GBFS/SiO 2 sheath underwent catastrophic failure in the first TS cycle; OPC/SiO 2 lost 78 % and TSRC 51 % of the bond strength in 6 cycles. Only TSRC-CS bond survived 30 days of strong acid exposure; OPC/SiO 2 bond failed after 18 days and GBFS/SiO 2 after 20 days. Addition of micro-glass fibers (MGF) to TSRC further improved its bond strength and CS corrosion protection. Samples of TSRC-CS cured for 30 days at 300 °C before the bond damage recovered 49 % of the damaged bond strength after additional short-time curing. The CS protected by the re-adhered TSRC showed low corrosion rate of 0.13 mm/year (TSRC-MGF), 0.2 mm/year (TSRC) vs. 0.64 mm/year for OPC/SiO 2 protected CS.

15 GEOTHERMAL ENERGY↗

DOE OSTI2017

Interactions between fluoride ions and cement paste containing superplasticizer

Fluoride compounds are used as fluxes in the low-temperature calcination of cement. Elution of fluoride ions after calcination decreases the fluidity of cement paste containing superplasticizers, but the mechanism of fluidity decrease is unclear. Authors investigated the effects of fluoride on cement pastes containing superplasticizers and the fluidity decrease mechanism. KF addition to cement paste containing a polycarboxylate- or naphthalenesulfonate-based superplasticizer increased the yield stress, the amount of adsorbed superplasticizer, and the solid-phase specific surface area. KF addition increased the amount of adsorbed superplasticizer for alite paste but not for Ca{sub 3}Al{sub 2}O{sub 6}-CaSO{sub 4} paste. Transmission electron microscopy found SiO{sub 2} fine particles after KF addition. In the absence of water, the increase in specific surface area with fluoride was larger in hydrated than in unhydrated cement. It is supposed that the fluidity decrease results from the preferential adsorption of superplasticizer on SiO{sub 2} particles generated by reactions between hydrated calcium silicate and fluoride ions.

36 MATERIALS SCIENCE↗

DOE OSTI2017

Production of H{sub 2} by water radiolysis in cement paste under electron irradiation: A joint experimental and theoretical study

Long-term confinement of nuclear waste is one of the main challenges faced by the nuclear industry. Fission products such as {sup 90}Sr and {sup 137}Cs, both β{sup −} emitters known to induce serious health hazards, represent the largest fraction of nuclear waste. Cement is a good candidate to store them, provided it can resist the effects of irradiation over time. Here, we have investigated the effects of β{sup −} decay on cement by performing electron irradiation experiments on different samples. We show that H{sub 2} production in cement, the main effect of water radiolysis, depends strongly on composition and relative humidity. First-principles calculations indicate that the water-rich interlayer regions with Ca{sup 2+} ions act as electron traps that promote the formation of H{sub 2}. They also show that holes localize in water-rich regions in low Ca content samples and are then able to participate in H{sub 2} production. This work provides new understanding of radiolysis effects in cements. - Graphical abstract: H{sub 2} produced by radiolysis in cement paste is investigated by experimental and computational studies.

36 MATERIALS SCIENCE↗

DOE OSTI2018

Influence of MWCNT/surfactant dispersions on the rheology of Portland cement pastes

This work studies the effect of MWCNT/surfactant aqueous dispersions on the rheology of cement paste. Three types of surfactants (sodium dodecyl sulfate, cetylpyridinium chloride and triton TX-100) were used to prepare cement pastes with and without MWCNT. Three rheological parameters were determined for each sample: static yield stress, yield stress, and viscosity. The first was measured directly, while the other two were obtained by fitting a Bingham model to the descending portion of a flow curve. Additionally, X-ray diffraction and isothermal calorimetry were used to follow the hydration reaction of cement during the first hour. It was found that the MWCNT/surfactant dispersions generate an overall shift to higher yield stress values while maintaining viscosity, suggesting a modification of the interparticle attraction. It was concluded that the triple interaction MWCNT-surfactant-cement governs the rheology of cement pastes.

36 MATERIALS SCIENCE↗

DOE OSTI2018

The effect of calcium lignosulfonate on ettringite formation in cement paste

The effect of a softwood calcium lignosulfonate, LSs, on the ettringite formed in cement paste was investigated. Two Portland cements, mainly differing in surface area and C{sub 3}A content, were used. The effect of LSs addition time was studied, by adding either the LSs immediately with the mixing water or after 10 min of hydration. After 30 min of hydration of both cement pastes, the immediate addition of LSs caused the formation of numerous small ettringite crystals. The ettringite crystals had similar shape in pastes with and without LSs addition: cubic or cuboidal shape with length between 0.1 and 0.4 μm. These small particles caused an increase in surface area, which in turn increased the LSs adsorption by the cement paste. This could potentially lead to incompatibility issues between cement and plasticizer.

36 MATERIALS SCIENCE↗

DOE OSTI2018

May reversible water uptake/release by hydrates explain the thermal expansion of cement paste? ÔÇö Arguments from an inverse multiscale analysis

Quasi-instantaneous thermal expansion of cement pastes is governed by the relative humidity (RH) within their air-filled pores and by the decrease/increase of this internal RH resulting from a temperature decrease/increase. The latter effect is traced back to quasi-instantaneous water uptake/release by cement hydrates, using microporomechanics and a three-scale representation of mature cement pastes. Partially saturated gel and capillary pores are considered to be connected and spherical, with radii following exponential distributions. The Mori-Tanaka scheme provides the scale transition from effective pore pressures to eigenstrains at the cement paste level. This modeling approach, together with considering mass conservation of water, allows for downscaling macroscopic thermal expansion coefficients, so as to identify the molecular water uptake/release characteristics of the hydrates. The latter characteristics are mixture-independent, as shown by their use for predicting the thermal expansion coefficients of different mature cement pastes, with w/c-ratios ranging from 0.50 to 0.70.

36 MATERIALS SCIENCE↗