Neural network approach to quantum-chemistry data: Accurate prediction of density functional theory energies
FREE-DOWNLOADRM Balabin… – The Journal of chemical physics, 2009 Artificial neural network (ANN) approach has been applied to estimate the density functional theory (DFT) energy with large basis set using lower-level energy values and molecular descriptors. A total of 208 different molecules were used for the ANN training, cross
Neural network approach to quantum-chemistry data: Accurate prediction of density functional theory energies
Neural network approach to quantum-chemistry data: Accurate prediction of density functional theory energies
Artificial Neural Network Modelling for the Study of pH on the Fungal Treatment of Red mud
FREE-DOWNLOAD D Diamond… – Research Journal of Chemical …, 2011 – isca.in The bioleaching of red mud a major waste in the aluminium industry obtained by alkaline treatment of bauxite was estimated in the present investigation by organic waste treatment. The waste was used as a media for fungal growth and maintained in the form […]