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Nanoparticles may have bigger impact on the environment than previously thought(图)
nanoparticle environment bigger impact on
2019/10/17
Over the last two decades, nanotechnology has improved many everyday products, from microelectronics to sunscreens. Nanoparticles (particles just a few hundred atoms in size) are ending up in the envi...
Impact of the Electron Density on the Fixed-Node Errors in Quantum Monte Carlo
the Electron Density the Fixed-Node Errors Quantum Monte Carlo
2011/8/5
Abstract: We analyze the effect of increasing charge density on the Fixed Node Errors in Diffusion Monte Carlo by comparing FN-DMC calculations of the total ground state energy on a 4 electron system ...