Difference between revisions of "Template:Reference list"
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| + | <ref name="caleman_2012"> | ||
| + | C. Caleman and P.J. van Maaren and M. Hong and J.S. Hub and L.T. Costa and D. van der Spoel. | ||
| + | ''Force field benchmark of organic liquids: Density, enthalpy of vaporization, heat capacities, surface tension, isothermal compressibility, volumetric expansion coefficient, and dielectric constant''. | ||
| + | [http://pubs.acs.org/doi/abs/10.1021/ct200731v J. Chem. Theory Comput. '''8''', 61 (2012)]. | ||
| + | </ref> | ||
| − | |||
<ref name="caro_2016"> | <ref name="caro_2016"> | ||
| − | M.A. Caro, T. Laurila, and O. Lopez-Acevedo. ''Accurate schemes for calculation of thermodynamic properties of liquid mixtures from molecular dynamics simulations'' [http://aip.scitation.org/doi/full/10.1063/1.4973001 J. Chem. Phys. '''145''', 244504 (2016)]. | + | M.A. Caro, T. Laurila, and O. Lopez-Acevedo. ''Accurate schemes for calculation of thermodynamic properties of liquid mixtures from molecular dynamics simulations''. [http://aip.scitation.org/doi/full/10.1063/1.4973001 J. Chem. Phys. '''145''', 244504 (2016)]. |
| + | </ref> | ||
| + | |||
| + | <ref name="lama_1965"> | ||
| + | R.F. Lama and B.C.-Y. Lu. ''Excess thermodynamic properties of aqueous alcohol solutions''. | ||
| + | [http://pubs.acs.org/doi/abs/10.1021/je60026a003 J. Chem. Eng. Data '''10''', 216 (1965)]. | ||
| + | </ref> | ||
| + | |||
| + | <ref name="lai_2012"> | ||
| + | P.-K. Lai, C.-M. Hsieh and S.-T. Lin. ''Rapid determination of entropy and free energy of mixtures from molecular dynamics simulations with the two-phase thermodynamic model''. [https://doi.org/10.1039/C2CP42011B Phys. Chem. Chem. Phys. '''14''', 15206 (2012)]. | ||
| + | </ref> | ||
| + | |||
| + | <ref name="lin_2003"> | ||
| + | S.-T. Lin, M. Blanco and W.A. Goddard III. ''The two-phase model for calculating thermodynamic properties of liquids from molecular dynamics: Validation for the phase diagram of Lennard-Jones fluids''. [https://aip.scitation.org/doi/10.1063/1.1624057 J. Chem. Phys. '''119''', 11792 (2003)]. | ||
| + | </ref> | ||
| + | |||
| + | <ref name="caro_2017b"> | ||
| + | M.A. Caro, O. Lopez-Acevedo, and T. Laurila}. ''Redox potentials from ab initio molecular dynamics and explicit entropy calculations: application to transition metals in aqueous solution''. | ||
| + | [https://pubs.acs.org/doi/abs/10.1021/acs.jctc.7b00314 J. Chem. Theory Comput. '''13''', 3432 (2017)]. | ||
</ref> | </ref> | ||
| − | <references | + | </references> |
