Molecular structure and dynamics of water on the surfaces of cement hydration products and associated Minerals: Nanoscale wettability behavior
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OpenAlex topics: Soil and Unsaturated Flow · Concrete and Cement Materials Research · Building materials and conservation
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References (62)
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1. Li · 2022
2. Mechanical properties, durability, and life-cycle assessment of self-consolidating concrete mixtures made with blended portland cements containing fly ash and limestone powder10.1016/j.cemconcomp.2014.11.003 ↗
3. Corrosion inhibitors in concrete repair systems10.1680/macr.2000.52.1.25 ↗
4. Bertolini · 2013
5. Diffusion behavior of chloride in coral aggregate concrete in marine salt-spray environment10.1016/j.conbuildmat.2021.125878 ↗
6. Effects of simulated environmental conditions on the internal relative humidity and relative moisture content distribution of exposed concrete10.1016/j.cemconcomp.2010.09.009 ↗
7. Effect of physical and chemical sulfate attack on performance degradation of concrete under different conditions10.1016/j.cplett.2020.137254 ↗
8. The experimental investigation of concrete carbonation depth10.1016/j.cemconres.2004.07.025 ↗
9. Use of sea-sand and seawater in concrete construction: Current status and future opportunities10.1016/j.conbuildmat.2017.08.130 ↗
10. Ding · 2023
11. Graphene-engineered cementitious composites: Small makes a big impact10.1177/1847980417742304 ↗
12. A review on the deterioration and approaches to enhance the durability of concrete in the marine environment10.1016/j.cemconcomp.2020.103695 ↗
13. Deterioration of marine concrete exposed to wetting-drying action10.1016/j.jclepro.2020.123383 ↗
14. Self-assembling particle-siloxane coatings for superhydrophobic concrete10.1021/am404272v ↗
15. Superhydrophobic concrete surfaces with integrated microtexture10.1016/j.cemconcomp.2014.05.010 ↗
16. The introduction of coastal infrastructure as a driver of change in marine environments10.1111/j.1365-2664.2009.01751.x ↗
17. Inner superhydrophobic materials based on waste fly ash: Microstructural morphology of microetching effects10.1016/j.compositesb.2023.111089 ↗
18. Hydrophobic or superhydrophobic modification of cement-based materials: A systematic review10.1016/j.compositesb.2022.110104 ↗
19. Adhesion Performance of Ettringite at the Interface with Silane and GO/Silane: Insights into Molecular Dynamics Simulations10.1021/acsomega.2c08123 ↗
20. Measuring the surface cohesion of calcium silicate hydrate10.1016/j.cemconres.2023.107369 ↗
21. Synthesis and application of new core-shell structure via Pickering emulsion polymerization stabilized by graphene oxide10.1016/j.compositesb.2022.110285 ↗
22. Preparation and evaluation of polymer/clay nanocomposite surface treatments for concrete durability enhancement10.1016/j.cemconcomp.2011.11.006 ↗
23. A review on recent advances in the fabrication and evaluation of superhydrophobic concrete10.1016/j.compositesb.2022.109867 ↗
24. Influences of modified nanoparticles on hydrophobicity of concrete with organic film coating10.1016/j.conbuildmat.2018.02.191 ↗
25. Design of SiO2/PMHS hybrid nanocomposite for surface treatment of cement-based materials10.1016/j.cemconcomp.2017.12.008 ↗
26. A review on concrete surface treatment Part I: Types and mechanisms10.1016/j.conbuildmat.2016.12.025 ↗
27. Biomimetic superhydrophobic surface of concrete: Topographic and chemical modification assembly by direct spray10.1016/j.conbuildmat.2018.06.063 ↗
28. Hydrophobic silane coating films for the inhibition of water ingress into the nanometer pore of calcium silicate hydrate gels10.1039/C9CP03266E ↗
29. Insights on the capillary transport mechanism in the sustainable cement hydrate impregnated with graphene oxide and epoxy composite10.1016/j.compositesb.2019.106907 ↗
30. Molecular insight in the wetting behavior of nanoscale water droplet on CSH surface: Effects of Ca/Si ratio10.1016/j.apsusc.2022.152811 ↗
31. Understanding the wetting discrepancy in calcium alumino silicate hydrate induced by Al/Si ratio10.1039/D1CP05900A ↗
32. Wetting behavior of metakaolinite on the basal surfaces–Molecular dynamics study10.1016/j.compgeo.2020.103863 ↗
33. Molecular structure and dynamics of water on the surface of cement hydration products: Wetting behavior at nanoscale10.1016/j.apsusc.2022.155713 ↗
34. Molecular models of hydroxide, oxyhydroxide, and clay phases and the development of a general force field10.1021/jp0363287 ↗
35. Atomistic simulations of ettringite and its aqueous interfaces: Structure and properties revisited with the modified ClayFF force field10.1016/j.cemconres.2022.106759 ↗
36. Engineering properties of concrete containing natural zeolite as supplementary cementitious material: Strength, toughness, durability, and hygrothermal performance10.1016/j.cemconcomp.2014.09.013 ↗
37. Durability enhancement of cement-based repair mortars through waterborne polyurethane modification: Experimental characterization and molecular dynamics simulations10.1016/j.conbuildmat.2024.137204 ↗
38. Mechanical properties and microstructure of waterborne polyurethane-modified cement composites as concrete repair mortar
39. Influence of the calcium sulphate source on the hydration mechanism of Portland cement–calcium sulphoaluminate clinker–calcium sulphate binders10.1016/j.cemconcomp.2011.03.005 ↗
40. Neutron diffraction refinement of the structure of gypsum, CaSO4. 2H2O, Acta Crystallographica Section B: Structural Crystallography and Crystal
41. Structures of the CaSO 4 (001) surface studied with atomic force microscopy in air and in solution10.1039/b007614g ↗
42. Calcium sulphate hemihydrate hydration leading to gypsum crystallization10.1016/j.pcrysgrow.2007.01.002 ↗
43. Force field for calcium sulfate minerals to predict structural, hydration, and interfacial properties10.1016/j.cemconres.2020.106262 ↗
44. Cooke · Langmuir · 2010 · 26 · 1452010.1021/la100670k ↗
45. Theoretical insights into the hydrated (10.4) calcite surface: Structure, energetics, and bonding relationships10.1021/la803652x ↗
46. An atomistic insight into interfacial properties of brine nanofilm confined between calcite substrate and hydrocarbon layer10.1016/j.apsusc.2019.05.337 ↗
47. S. Hamid, The crystal structure of the 11Å natural tobermorite Ca2. 25 [Si3O7. 5 (OH) 1.5]· 1H2O, Zeitschrift für Kristallographie-Crystalline Materials, 154 (1981) 189–198.10.1524/zkri.1981.154.3-4.189 ↗
48. A realistic molecular model of cement hydrates10.1073/pnas.0902180106 ↗
49. Molecular dynamics simulation study on the hydrophobic mechanism of ettringite nanoporous channels modified by silane and silane/graphene oxide10.1016/j.apsusc.2023.156975 ↗
50. Sulfate anion in water: model structural, thermodynamic, and dynamic properties10.1021/j100075a027 ↗
51. Molecular dynamics modeling of chloride binding to the surfaces of calcium hydroxide, hydrated calcium aluminate, and calcium silicate phases10.1021/cm0107070 ↗
52. Ionic hydration structure, dynamics and adsorption mechanism of sulfate and sodium ions in the surface of calcium silicate hydrate gel: a molecular dynamics study10.1016/j.apsusc.2018.04.071 ↗
53. Thermodynamically consistent force field for molecular dynamics simulations of alkaline-earth carbonates and their aqueous speciation10.1021/acs.jpcc.5b07532 ↗
54. LAMMPS-large-scale atomic/molecular massively parallel simulator
55. Molecular dynamics simulations on the interface between titanium dioxide and water droplets: A new model for the contact angle10.1021/jp811257x ↗
56. Concentration-induced wettability alteration of nanoscale NaCl solution droplets on the CSH surface10.1039/D0CP06270G ↗
57. On the role of the amphiphobic surface properties in droplet wetting behaviors via molecular dynamics simulation10.1016/j.apsusc.2020.148916 ↗
58. Dipole moment, hydrogen bonding and IR spectrum of confined water10.1002/cphc.200600561 ↗
59. Dipole moments of water molecules confined in Na–LSX zeolites–Molecular dynamics simulations including polarization of water10.1016/j.cplett.2005.09.130 ↗
60. Glassy nature of water in an ultraconfining disordered material: the case of calcium− silicate− hydrate10.1021/ja107003a ↗
61. Free energy of adsorption of water and metal ions on the 1014 calcite surface10.1021/ja0487776 ↗
62. Molecular dynamics simulations of the interactions between water and inorganic solids10.1039/b415633c ↗