Browsing NTNU Open by Author "Khaledialidusti, Rasoul"
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Atomic defects in monolayer ordered double transition metal carbide (Mo2TiC2Tx) MXene and CO2 adsorption
Khaledialidusti, Rasoul; Mishra, Abhishek Kumar; Barnoush, Afrooz (Peer reviewed; Journal article, 2020)Transition metal carbides (MXenes) with formula Mn+1CnTx (n = 2 and 3) have been emerging as a new family of two-dimensional (2D) materials that have great potential in electronic applications and CO2 conversion catalysts. ... -
CO2 Adsorption and Activation on the (110) Chalcopyrite Surfaces: A Dispersion-Corrected DFT + U Study
Khaledialidusti, Rasoul; Kumar Mishra, Abhishek; Barnoush, Afrooz (Journal article; Peer reviewed, 2019)We have used the density functional theory within the plane-wave framework to understand the reconstruction of most stable (110) chalcopyrite surfaces. Reconstructions of the polar surfaces are proposed, and three different ... -
Effects of interlayer density and surfactant on coupled thermal stress and moisture absorption in modified montmorillonite/polypropylene nanocomposite
Mahdavi, Ehsan; Khaledialidusti, Rasoul (Peer reviewed; Journal article, 2020)Modified montmorillonite/polypropylene nanocomposites (NCs) are increasingly used in industrial applications such as subsea pipelines because hexadecyltrimethyl ammonium montmorillonite (HDTMA+‐Mt) enhances thermomechanical ... -
Evaluation of surfactant flooding using interwell tracer analysis
Khaledialidusti, Rasoul; Kleppe, Jon; Enayatpour, Saeid (Journal article; Peer reviewed, 2017)Surfactant flooding is an important enhanced oil recovery (EOR) method, especially in carbonate oil reservoirs where water flooding may not have an effect on oil recovery as much as for sandstone reservoirs. This is because ... -
Exploring structural, electronic, and mechanical properties of 2D hexagonal MBenes
Khaledialidusti, Rasoul; Khazaei, Mohammad; Wang, Vei; Miao, Nanxi; Si, Chen; Wang, Jianfeng; Wang, Junjie (Peer reviewed; Journal article, 2020)A family of two-dimensional (2D) transition metal borides, referred to as MBenes, is recently emerging as novel materials with great potentials in electronic and energy harvesting applications to the field of materials ... -
Neutron diffraction study of temperature-dependent elasticity of B19′ NiTi---Elinvar effect and elastic softening
Ahadi, Aslan; Khaledialidusti, Rasoul; Kawasaki, Takuro; Harjo, Stefanus; Barnoush, Afrooz; Tsuchiya, Koichi (Peer reviewed; Journal article, 2019)The temperature-dependent elasticity of the B19′ NiTi is unknown today. To gain insights into the lattice-level temperature-dependent elasticity of the B19′ crystal, we present results of in-situ neutron diffraction ... -
Pd-Functionalized ZnO:Eu Columnar Films for Room-Temperature Hydrogen Gas Sensing: A Combined Experimental and Computational Approach
Lupan, Christian; Khaledialidusti, Rasoul; Kumar Mishra, Abhishek (Peer reviewed; Journal article, 2020)Reducing the operating temperature to room temperature is a serious obstacle on long-life sensitivity with long-term stability performances of gas sensors based on semiconducting oxides, and this should be overcome by new ... -
Reservoir Characterization and Determination of Residual Oil Saturation Using Single-Well- Chemical-Tracer Test - Significance of Geochemistry, Rock Dissolution, and Surface-Charge Alteration
Khaledialidusti, Rasoul (Doctoral theses at NTNU;2017:350, Doctoral thesis, 2017)It is generally recognized that the determination of residual oil saturation (Sor) plays a significant role in production forecasting and the selection and management of enhanced oil recovery (EOR) methods. Failure to ... -
Rheological properties of super critical CO2 with Al2O3: Material type, size and temperature effect
Mahdavi, Ehsan; Khaledialidusti, Rasoul; Barnoush, Afrooz (Peer reviewed; Journal article, 2019)CO2 liquid is applied as an Enhanced Oil Recovery (EOR) method in oil reservoirs to increase the displacement efficiency. Because of the high temperature and pressure in the reservoirs, the viscosity of the CO2 decreases ... -
Rheological properties of super critical CO2 with CuO: Multi-scale computational modeling
Khaledialidusti, Rasoul; Mishra, Abhishek Kumar; Barnoush, Afrooz (Journal article; Peer reviewed, 2018)A multi-scale computational methodology based on the density functional theory and molecular dynamics has been used to investigate the rheological properties of super critical CO2 with CuO nano-particle (NP). Density ... -
Shear viscosity calculation of water in nanochannel: molecular dynamics simulation
Shadloo-Jahromi, Alireza; Khaledialidusti, Rasoul (Peer reviewed; Journal article, 2020)Shear viscosity is one of the important transport properties which affects different phenomena in nanoconfined water. This study aims to investigate the effect of sub-Angstrom variations of nanochannel size on the shear ... -
Significance of Geochemistry in Single-Well Chemical-Tracer Tests by Coupling a Multiphase-Flow Simulator to the Geochemical Package
Khaledialidusti, Rasoul; Kleppe, Jon (Journal article; Peer reviewed, 2018)Single-well chemical tracer (SWCT) is the most commonly used field method to determine oil or water saturation in one-well enhanced-oil-recovery (EOR) pilots. Because hydrolysis of an ester, which is the main part of the ... -
Stabilization of 2D graphene, functionalized graphene, and Ti2CO2 (MXene) in super-critical CO2: A molecular dynamics study
Khaledialidusti, Rasoul; Mahdavi, Ehsan; Barnoush, Afrooz (Journal article; Peer reviewed, 2019) -
Surface-Charge Alteration at the Carbonate/Brine Interface During Single-Well Chemical-Tracer Tests: Surface-Complexation Model
Khaledialidusti, Rasoul; Kleppe, Jon (Journal article; Peer reviewed, 2018)Water chemistry has been shown to affect oil recovery by affecting surface charge and rock dissolution. The single-well chemical-tracer (SWCT) test is a field method to measure residual oil saturation (Sor), in which ... -
Temperature-dependent mechanical properties of Tin+1CnO2 (n= 1, 2) MXene monolayers: a first-principles study
Khaledialidusti, Rasoul; Anasori, Babak; Barnoush, Afrooz (Peer reviewed; Journal article, 2020)Two-dimensional (2D) transition metal carbides, carbonitrides, and nitrides (named as MXenes) have become of the fastest growing family of 2D materials in terms of compositions and their applications in different areas. ... -
Temperature-dependent properties of magnetic CuFeS2 from first-principles calculations: Structure, mechanics, and thermodynamics
Khaledialidusti, Rasoul; Kumar Mishra, Abhishek; Barnoush, Afrooz (Journal article; Peer reviewed, 2019)Chalcopyrite (CuFeS2) is an antiferromagnetic semiconductor with promising magnetic and electrical properties, although these properties are not yet completely understood. The structural, magnetic, and electronic properties ...