Machine learning software to learn negligible elements of the Hamiltonian matrix
Explore the source record for details and available documents.
Chen Qu↗
Engineering topics
Qi Yu
Publications and source records attributed to Qi Yu.
Semiclassical and VSCF/VCI Calculations of the Vibrational Energies of trans - and gauche -Ethanol Using a CCSD(T) Potential Energy Surface
Explore the source record for details and available documents.
Riccardo Conte↗
A Δ-machine learning approach for force fields, illustrated by a CCSD(T) 4-body correction to the MB-pol water potential
Explore the source record for details and available documents.
Chen Qu↗
Ab Initio Potential Energy Surface for NaCl–H 2 with Correct Long-Range Behavior
Explore the source record for details and available documents.
Priyanka Pandey↗
Correction: A Δ-machine learning approach for force fields, illustrated by a CCSD(T) 4-body correction to the MB-pol water potential
Explore the source record for details and available documents.
Chen Qu↗
Manipulating hydrogen bond dissociation rates and mechanisms in water dimer through vibrational strong coupling
Explore the source record for details and available documents.
Qi Yu↗