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Article
Mass effects for thermodiffusion in dilute aqueous solutions
Thermodiffusion is the phenomenon by which molecules in a mixture present concentration gradients in response to an imposed temperature gradient. Despite decades of investigations, this effect remains poorly u...
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Article
Distributed Gaussian orbitals for the description of electrons in an external potential
In this work, we demonstrate the viability of using distributed Gaussian orbitals as a basis set for the calculation of the properties of electrons subjected to an external potential. We validate our method by...