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DynDen: Assessing convergence of molecular dynamics simulations of interfaces (2021)
Journal Article
Degiacomi, M. T., Tian, S., Greenwell, H. C., & Erastova, V. (2021). DynDen: Assessing convergence of molecular dynamics simulations of interfaces. Computer Physics Communications, 269, Article 108126. https://doi.org/10.1016/j.cpc.2021.108126

Molecular dynamics is a simulation technique used to predict the physical properties of systems based on their chemical structure and evolution of their atomic constituents. For these predictions to be reliable, it is critical that the simulation has... Read More about DynDen: Assessing convergence of molecular dynamics simulations of interfaces.

A method for automatic shale porosity quantification using an Edge-Threshold Automatic Processing (ETAP) technique (2021)
Journal Article
Tian, S., Bowen, L., Liu, B., Zeng, F., Xue, H., Erastova, V., Greenwell, H. C., Dong, Z., Zhao, R., & Liu, J. (2021). A method for automatic shale porosity quantification using an Edge-Threshold Automatic Processing (ETAP) technique. Fuel, 304, Article 121319. https://doi.org/10.1016/j.fuel.2021.121319

Scanning electron microscopy (SEM) is one of the most prevalent methods used to image and quantify the pore size distribution of shale rock, critical in understanding unconventional petroleum systems and production. Generally, digital greyscale SEM i... Read More about A method for automatic shale porosity quantification using an Edge-Threshold Automatic Processing (ETAP) technique.