An updated LAMMPS version of H-AdResS enables dual-resolution simulations of interfaces in porous solids, keeping atomistic accuracy while raising efficiency.
Carbone , author H
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A literature survey of supramolecular assembly at organic-semiconductor interfaces and its effects on transistors, LEDs, and photovoltaics, plus simulation challenges.
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Extending Hamiltonian-Adaptive Resolution Simulation to Interfaces: An Updated LAMMPS Implementation and Application to Porous Solids
An updated LAMMPS version of H-AdResS enables dual-resolution simulations of interfaces in porous solids, keeping atomistic accuracy while raising efficiency.
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The interplay of interfaces, supramolecular assembly, and electronics in organic semiconductors
A literature survey of supramolecular assembly at organic-semiconductor interfaces and its effects on transistors, LEDs, and photovoltaics, plus simulation challenges.