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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N. V. Priezjev, “Molecular diffusion and slip boundary conditions at smooth surfaces with periodic and random nanoscale textures”, J. Chem. Phys., vol. 135, 2011.

N. V. Priezjev, “Rate-dependent slip boundary conditions for simple fluids”, Physical Review E, vol. 75, no. 5, p. 51605, 2007.

N. V. Priezjev, “Shear rate threshold for the boundary slip in dense polymer films”, Phys. Rev. E, vol. 80, no. 3, p. 11 Pages, 2009.

N. V. Priezjev, “Interfacial friction between semiflexible polymers and crystalline surfaces”, J. Chem. Phys., vol. 136, 2012.

N. V. Priezjev, “Effect of surface roughness on rate-dependent slip in simple fluids”, The Journal of Chemical Physics, vol. 127, no. 14, p. 144708, 2007.

N. V. Priezjev, “Heterogeneous relaxation dynamics in amorphous materials under cyclic loading”, Physical Review E, vol. 87, no. 5, 2013.

N. V. Priezjev, “Relationship between induced fluid structure and boundary slip in nanoscale polymer films”, Physical Review E, vol. 82, 2010.

N. V. Priezjev, “Molecular dynamics simulations of oscillatory Couette flows with slip boundary conditions”, Microfluidics and Nanofluidics, vol. 14, no. 1-2, 2013.

C. G. Prichard and Bence, J. R., “Estimating wounding of lake trout by sea lamprey in the upper Great Lakes: Allowing for changing size-specific patterns”, Journal of Great Lakes Research, p. -, 2013.

J. Portman, Zhang, H., Makino, K., Ruan, C. Y., Berz, M., and Duxbury, P. M., “Untangling the contributions of image charge and laser profile for optimal photoemission of high-brightness electron beams”, Journal of Applied Physics, vol. 116, 2014.

I. Popov, Seifert, G., and Tománek, D., “Designing Electrical Contacts to ${\mathrm{MoS}}_{2}$ Monolayers: A Computational Study”, Phys. Rev. Lett., vol. 108, p. 156802, 2012.

J. Pittner and Piecuch, P., “Method of Moments for the Continuous Transition Between the Brillouin-Wigner-Type and Rayleigh-Schrodinger-Type Multireference Coupled Cluster Theories”, Molecular Physics, vol. 107, no. 08-12, pp. 1209-1221, 2009.

W. Pitchers, Pool, J. E., and Dworkin, I., “ALTITUDINAL CLINAL VARIATION IN WING SIZE AND SHAPE IN AFRICAN DROSOPHILA MELANOGASTER: ONE CLINE OR MANY?”, Evolution, vol. 67, pp. 438–452, 2012.

B. Pijanowski, Moore, N., Mauree, D., and Niyogi, D., “Evaluating error propagation in coupled land-atmosphere models”, Earth Interactions, vol. 15, 2011.

P. Piecuch, Wloch, M., Logriguito, M. D., and Gour, J. R., “Two New Classes of Non-Iterative Coupled-Cluster Methods Derived from the Method of Moments of Coupled-Cluster Equations”, Molecular Physics, vol. 104, no. 13 & 14, pp. 2149-2172, 2006.

P. Piecuch, Wloch, M., Lodriguito, M., and Gour, J. R., “Non-iterative Coupled-Cluster Methods for Excited Electronic States”, in Progress in Theoretical Chemistry and Physics, vol. 15, 2006, pp. 45-106.

P. Piecuch, Gour, J. R., and Wloch, M., “Active-Space Equation-of=Motion Coupled-Cluster Methods for Excited States of Radicals and Other Open-Shell Systems: EA-EOMCCSDt and IP-EOMCCSDt”, Journal of Chemical Physics, vol. 123, no. 13, p. 14 pages, 2005.

P. Piecuch, Pimienta, I. S. O., Fan, P. - D., and Kowalski, K., “New Alternatives for Accurate Electronic Structure Calculations of Potential Energy Surfaces Involving Bond Breaking”, in Electron Correlation Methodology, vol. 958, Washington, DC: American Chemical Sociegy, 2007.

P. Piecuch, Hirata, S., Kowalski, K., Fan, P. - D., and Windus, T. L., “Automated derivation and parallel computer implementation of renormalized and active-space coupled-cluster methods”, International Journal of Quantum Chemistry, vol. 106, no. 1, pp. 79–97, 2006.

P. Piecuch, Kowalski, K., Pimienta, I. S. O., Fan, P. - D., Lodriguito, M. D., McGuire}, M. J. {, Kucharski, S. A., Kuś, T., and Musial, M., “Method of moments of coupled-cluster equations: a new formalism for designing accurate electronic structure methods for ground and excited states”, Theoretical Chemistry Accounts: Theory, Computation, and Modeling, vol. 112, pp. 349–393, 2004.

P. Piecuch and McGuire}, M. J. {, “Balancing Dynamic and Non-Dynamic Correlation for Diradical and Aromatic Transition States: A Renormalized Coupled-Cluster Study of the Cope Rearrangement of 1,5-Hexadiene”, Journal of the American Chemical Society, vol. 127, no. 8, pp. 2608-2614, 2005.

P. Piecuch, Gour, J. R., and Wloch, M., “Left-Eigenstate Completely Renormalized Equation-of-motion Coupled-Cluster Methods: Review of Key Concepts, Extension to Excited States of Open-Shell Systems, and Comparison with Electron-Attached and ionized Approaches”, International Journal of Quantum Chemistry, vol. 109, no. 14, pp. 3268-3304, 2009.

P. Piecuch, Gour, J. R., and Wloch, M., “Extension of the Active-Space Equation-of- Motion Coupled-Cluster Methods to Radical Systems: The EA-EOMCCSDt and IPEOMCCSDt Approaches”, International Journal of Quantum Chemistry, vol. 106, no. 14, pp. 2854-2874, 2006.

P. Piecuch and Wloch, M., “Renormalized coupled-cluster methods exploiting left eigenstates of the similarity-transformed Hamiltonian”, The Journal of Chemical Physics, vol. 123, no. 22, pp. 224105–10, 2005.

P. Piecuch, Wloch, M., Gour, J. R., and Kowalski, K., “Extension of Renormalized Coupled-Cluster Methods Including Triple Excitations to Electronic States of Open-Shell Molecules”, The Journal of Chemical Physics, vol. 122, no. 21, 2005.

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