Marie Laury
Affiliations: | University of North Texas, Denton, TX, United States |
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| Manivasagam S, Laury ML, Wilson AK. (2015) Pseudopotential-Based Correlation Consistent Composite Approach (rp-ccCA) for First- and Second-Row Transition Metal Thermochemistry. The Journal of Physical Chemistry. A. 119: 6867-74 |
| Laury ML, Wilson AK. (2013) Performance of Density Functional Theory for Second Row (4d) Transition Metal Thermochemistry. Journal of Chemical Theory and Computation. 9: 3939-46 |
| Jiang W, Laury ML, Powell M, et al. (2012) Comparative Study of Single and Double Hybrid Density Functionals for the Prediction of 3d Transition Metal Thermochemistry. Journal of Chemical Theory and Computation. 8: 4102-11 |
| Laury ML, Wilson AK. (2012) Examining the heavy p-block with a pseudopotential-based composite method: atomic and molecular applications of rp-ccCA. The Journal of Chemical Physics. 137: 214111 |
| Laury ML, Carlson MJ, Wilson AK. (2012) Vibrational frequency scale factors for density functional theory and the polarization consistent basis sets. Journal of Computational Chemistry. 33: 2380-7 |
| Laury ML, DeYonker NJ, Jiang W, et al. (2011) A pseudopotential-based composite method: the relativistic pseudopotential correlation consistent composite approach for molecules containing 4d transition metals (Y-Cd). The Journal of Chemical Physics. 135: 214103 |
| Laury ML, Boesch SE, Haken I, et al. (2011) Harmonic vibrational frequencies: scale factors for pure, hybrid, hybrid meta, and double-hybrid functionals in conjunction with correlation consistent basis sets. Journal of Computational Chemistry. 32: 2339-47 |