Publications
The following are publications made possible by iCER resources. MSU faculty that would like to highlight the output of their research that's benefited from iCER resources are invited to contact us.
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, “Reversible Unwrapping Algorithm for Constant-Pressure Molecular Dynamics Simulations”, Journal of Chemical Theory and Computation, vol. 18, no. 10, pp. 6161 - 6171, 2022.
, “Long-term differences in tillage and land use affect intra-aggregate pore heterogeneity”, Soil Sci. Soc Am J, vol. 75, pp. 1658-1666, 2011.
, “Computational Investigation of the Conrotatory and Disrotatory Isomerization Channels of Bicyclo[1.1.0]butane to Buta-1,3-diene: A Completely Renormalized Coupled-Cluster Study”, Journal of Physical Chemistry A, vol. 111, no. 4, pp. 734-742, 2007.
, “Lessons Learned When Building a Greenfield High Performance Computing Ecosystem”, in 26th Large Installation System Administration conference {LISA), San Diego, California, USA, 2012.