Nathan E. Schultz, Ph.D.
Affiliations: | 2006 | University of Minnesota, Twin Cities, Minneapolis, MN |
Area:
Theoretical and Computational ChemistryGoogle:
"Nathan Schultz"Mean distance: 9.37 | S | N | B | C | P |
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Publications
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| Lewin JL, Maerzke KA, Schultz NE, et al. (2010) Prediction of Hildebrand solubility parameters of acrylate and methacrylate monomers and their mixtures by molecular simulation Journal of Applied Polymer Science. 116: 1-9 |
| Zhao M, Iron MA, Staszewski P, et al. (2009) Valence-Bond Order (VBO): A New Approach to Modeling Reactive Potential Energy Surfaces for Complex Systems, Materials, and Nanoparticles. Journal of Chemical Theory and Computation. 5: 594-604 |
| Maerzke KA, Schultz NE, Ross RB, et al. (2009) TraPPE-UA force field for acrylates and Monte Carlo simulations for their mixtures with alkanes and alcohols. The Journal of Physical Chemistry. B. 113: 6415-25 |
| Miller SR, Schultz NE, Truhlar DG, et al. (2009) A study of the ground and excited states of Al3 and Al3(-). II. Computational analysis of the 488 nm anion photoelectron spectrum and a reconsideration of the Al3 bond dissociation energy. The Journal of Chemical Physics. 130: 024304 |
| Zhao M, Iron MA, Staszewski P, et al. (2009) Valence-bond order (VBO): A new approach to modeling reactive potential energy surfaces for complex systems, materials, and nanoparticles Journal of Chemical Theory and Computation. 5: 594-604 |
| Schultz NE, Zhao Y, Truhlar DG. (2008) Benchmarking approximate density functional theory for s/d excitation energies in 3d transition metal cations. Journal of Computational Chemistry. 29: 185-9 |
| Jasper AW, Schultz NE, Truhlar DG. (2007) Transferability of Orthogonal and Nonorthogonal Tight-Binding Models for Aluminum Clusters and Nanoparticles. Journal of Chemical Theory and Computation. 3: 210-8 |
| Li ZH, Bhatt D, Schultz NE, et al. (2007) Free energies of formation of metal clusters and nanoparticles from molecular simulations: Al n with n = 2 - 60 Journal of Physical Chemistry C. 111: 16227-16242 |
| Rai N, Siepmann JI, Schultz NE, et al. (2007) Pressure dependence of the hildebrand solubility parameter and the internal pressure: Monte Carlo simulations for external pressures up to 300 MPa Journal of Physical Chemistry C. 111: 15634-15641 |
| Schultz NE, Jasper AW, Bhatt D, et al. (2007) Aluminum Nanoparticles: Accurate Potential Energy Functions and Physical Properties Multiscale Simulation Methods For Nanomaterials. 169-188 |