Ajay Mohan Singh Rawat

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Questions related from Ajay Mohan Singh Rawat

Is it necessary to calculate the BSSE (using counterpoise correction) along with CBS energies while constructing a global PES for triatomic surface?

We are constructing the global potential energy surface for a triatomic system to study the A + BC -> AB + C type of reaction. We are using CBS limit to calculate the ab initio energies (using...

13 January 2023 7,876 2 View

How to implement the Levenberg–Marquardt algorithm as an optimization algorithm in Keras?

We are building a feed forward neural network and need to use the Levenberg–Marquardt algorithm as a starting point of optimization algorithm but this algorithm is not available as a part of...

20 December 2022 7,339 2 View