MōLe-Λ learns the full CCSD response state (T1,T2,Λ1,Λ2) from HF orbitals to deliver energies, gradients and multiple response properties.
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M\=oLe-{\Lambda}: Learning the Coupled-Cluster Response State for Energies, Gradients, and Properties
MōLe-Λ learns the full CCSD response state (T1,T2,Λ1,Λ2) from HF orbitals to deliver energies, gradients and multiple response properties.