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Hello, I would like to import and call a c++ library from python. The library is the freely available (c++) LAMMPS Molecular dynamics code, and on the website, the following advice is given: "[one can]...build LAMMPS as a library. Once this is done, you can interface with LAMMPS either via …
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I would like to construct a neighbour list of multiple atoms. [CODE=python] AllAtoms = {} AllAtoms[0] = [0,[]] AllAtoms[1] = [0,[AllAtoms[0][0]]] AllAtoms[2] = [0,[AllAtoms[0][0]]] [/CODE] Every member of the dictionary is referencing other members of the dictionary. I do not know how to make this reference work so that when …
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Hello all, I performing simulations in metals, using a mixture of free code and my own code, which is in C, C++ and Python. I am currently trying to write everything new in Python so that other members of my lab can more easily understand the code. I am also … |