A Voxel-based Approach for Simulating Microbial Decomposition in Soil: Comparison with LBM and Improvement of Morphological Models

This study presents a new computational approach for simulating the microbial decomposition of organic matter, from 3D micro-computed tomography (micro-CT) images of soil. The method employs a valuated graph of connected voxels to simulate transformation and diffusion processes involved in microbial decomposition within the complex soil matrix. The resulting model can be adapted to simulate any diffusion-transformation processes in porous media. We implemented parallelization strategies and explored different numerical methods, including implicit, explicit, synchronous, and asynchronous schemes. To validate our method, we compared simulation outputs with those provided by LBioS and by Mosaic models. LBioS uses a lattice-Boltzmann method for diffusion and Mosaic takes benefit of Pore Network Geometrical Modelling (PNGM) by means of geometrical primitives such as spheres and ellipsoids. This approach achieved comparable results to traditional LBM-based simulations, but required only one-fourth of the computing time. Compared to Mosaic simulation, the proposed method is slower but more accurate and does not require any calibration. Furthermore, we present a theoretical framework and an application example to enhance PNGM-based simulations. This is accomplished by approximating the diffusional conductance coefficients using stochastic gradient descent and data generated by the current approach.

Generic tool for numerical simulation of transformation-diffusion processes in complex volume geometric shapes: application to microbial decomposition of organic matter

This paper presents a generic framework for the numerical simulation of transformation-diffusion processes in complex volume geometric shapes. This work follows a previous one devoted to the simulation of microbial degradation of organic matter in porous system at microscopic scale. We generalized and improved the MOSAIC method significantly and thus yielding a much more generic and efficient numerical simulation scheme. In particular, regarding the simulation of diffusion processes from the graph, in this study we proposed a completely explicit and semi-implicit numerical scheme that can significantly reduce the computational complexity. We validated our method by comparing the results to the one provided by classical Lattice Boltzmann Method (LBM) within the context of microbial decomposition simulation. For the same datasets, we obtained similar results in a significantly shorter computing time (i.e., 10-15 minutes) than the prior work (several hours). Besides the classical LBM method takes around 3 weeks computing time.