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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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.
P. Piecuch, Chaudhuri, R. K., Freed, K. F., Hose, G., Kowalski, K., Wloch, M., Chattopadhyay, S., Mukherjee, D., Rolik, R., Szabados, A., Toth, G., and Surjan, P. R., Comparison of Low-Order Multireference Many-Body Perturbation Theories, Journal of Chemical Physics, vol. 122, no. 13, p. 9 pages, 2005.
P. Piecuch and Sherrill, C. D., A Comparison of Renormalized Coupled-Cluster and Multireference Methods with Full Configuration Interaction Benchmarks, Journal of Chemical Physics, vol. 122, no. 12, 2005.
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, Zhao, Y., and Truhlar, D. G., Thermochemical Kinetics for Multi-reference Systems: Addition Reactions of Ozone, Journal of Physical Chemistry A, vol. 113, no. 19, pp. 5786-5799, 2009.
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., Dean, D. J., Gour, J. R., Hjorth-Jensen}, M. {, Kowalski, K., and Papenbrock, T., Ab Initio Coupled-Cluster Study of O, Physical Review Letters, vol. 94, 2005.
P. Piecuch and Kowalski, K., Extensive Generalization of Renormalized Coupled-Cluster Methods, The Journal of Chemical Physics, vol. 122, no. 7, 2005.
P. Piecuch, Wloch, M., and Verandas, A. J. C., Renormalized Coupled-Cluster Methods: Theoretical Foundations and Application to Potential Function of Water, in Progress in Theoretical Chemistry and Physics, vol. 16, no. Part 1, 2007, pp. 63-121.
P. Piecuch, Wloch, M., Gour, J. R., and Kinal, A., Single-reference, size-extensive, non-iterative coupled-cluster approaches to bond breaking and biradicals, Chemical Physics Letters, vol. 418, pp. 467–474, 2006.
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, Fan, {P. - D. }, and Kowalski, K., Noniterative Corrections to Extended Coupled-Cluster Energies Employing the Generalized Method of Moments of Coupled-Cluster Equations, Molecular Physics, vol. 103, no. 15 & 16, pp. 2191-2213, 2005.
B. Pijanowski, Moore, N., Mauree, D., and Niyogi, D., Evaluating error propagation in coupled land-atmosphere models, Earth Interactions, vol. 15, 2011.
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.
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.
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. 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.
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.
N. V. Priezjev, Heterogeneous relaxation dynamics in amorphous materials under cyclic loading, Physical Review E, vol. 87, no. 5, 2013.
N. V. Priezjev, Molecular dynamics simulations of oscillatory Couette flows with slip boundary conditions, Microfluidics and Nanofluidics, vol. 14, no. 1-2, 2013.
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, Relationship between induced fluid structure and boundary slip in nanoscale polymer films, Physical Review E, vol. 82, 2010.
N. V. Priezjev, Interfacial friction between semiflexible polymers and crystalline surfaces, J. Chem. Phys., vol. 136, 2012.
N. V. Priezjev, Molecular diffusion and slip boundary conditions at smooth surfaces with periodic and random nanoscale textures, J. Chem. Phys., vol. 135, 2011.

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