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20092019
most citedDeep Neural Network Computes Electron Densities and Energies of a Large Set of Organic Molecules Faster than Density Functional Theory (DFT)

36 citations · 75 across the 6 of their papers we have counts for

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physics.chem-ph2018★ 36 cited

Deep Neural Network Computes Electron Densities and Energies of a Large Set of Organic Molecules Faster than Density Functional Theory (DFT)

Anton V. Sinitskiy, Vijay S. Pande

Density functional theory (DFT) is one of the main methods in Quantum Chemistry that offers an attractive trade off between the cost and accuracy of quantum chemical computations.…