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List of works by Apurba Nandi

A Machine Learning Approach for Prediction of Rate Constants

scientific article published on 26 August 2019

A combined theoretical and experimental study of phenol-(acetylene)n (n ≤ 7) clusters

scientific article published in April 2017

Breaking the bottleneck: Use of molecular tailoring approach for the estimation of binding energies at MP2/CBS limit for large water clusters

scientific article published on 01 March 2016

Diffusion Monte Carlo Calculations of Zero-Point Energies of Methanol and Deuterated Methanol

article

Quantum Calculations on a New CCSD(T) Machine-Learned Potential Energy Surface Reveal the Leaky Nature of Gas-Phase <i>Trans</i> and <i>Gauche</i> Ethanol Conformers

scientific article published in 2022

Toward an Accurate and Inexpensive Estimation of CCSD(T)/CBS Binding Energies of Large Water Clusters

scientific article published on 08 July 2016

Using Gradients in Permutationally Invariant Polynomial Potential Fitting: A Demonstration for CH4 Using as Few as 100 Configurations

scientific article published on 01 April 2019

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