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Long-range dispersion effects on the water/vapor interface simulated using the most common models
Marcello Sega, Christoph Dellago
The long-range contribution to dispersion forces is known to have a major impact on the properties of inhomogeneous fluids, and its correct treatment is increasingly recognized as…
Universal criterion for designability of heteropolymers
Chiara Cardelli, Valentino Bianco, Lorenzo Rovigatti +4
Proteins are an example of heteropolymers able to self-assemble in specific target structures. The self-assembly of designed artificial heteropolymers is still, to the best of our…
Nucleation and structural growth of cluster crystals
Christian Leitold, Christoph Dellago
We study the nucleation of crystalline cluster phases in the generalized exponential model with exponent n=4. Due to the finite value of this pair potential for zero separation, at…