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Questions related from Christopher Paredes Arroyo
Currently perform a molecular dynamics simulation of a suspension of nanoparticles between two walls , explicit , at different temperatures . The density profiles obtained indicate that there is...
06 June 2016 9,389 0 View
Hello everyone, using molecular dynamics I have confined nanoparticle suspension between two walls at different temperatures . The separation of the walls is 14nm , and I am using differences...
02 February 2016 6,586 2 View
According to what I have seen, many molecular dynamics simulations do not care about the conservation of angular momentum . What I can affect the thermodynamic results that the angular momentum is...
09 September 2015 456 6 View
For a molecular dynamics simulation , which is the time scale on which we can see the Soret effect a suspension of nanoparticles dispersed in an explicit solvent ?. I just want an estimate , how...
09 September 2015 224 1 View
Anyone know of a good review where all types of walls / borders that can be used in a molecular dynamics simulation ?. Boundary conditions in general : ie: periodic , empty , fixed, implicit walls...
09 September 2015 5,949 0 View
Hi all, someone knows a trick in molecular dynamics for contacting a fluid (solvent explicit ) with a wall fixed temperature but using an implicit wall ( idealized impenetrable wall that interacts...
09 September 2015 5,965 3 View
Any reference EMD or NEMD algorithms to determine the diffusion coefficient of solute particles in an explicit solvent which is subjected to a temperature gradient ?
08 August 2015 6,260 4 View
Someone can provide me a reference for determining from a computer simulation of a colloidal system if this flocculating or has precipitated ? I recommend criteria to determine this?
08 August 2015 7,990 1 View
