most citedExploration of interlacing and avoided crossings in a manifold of potential energy curves by a Unitary Group Adapted State Specific Multi-Reference Perturbation Theory (UGA-SSMRPT)

4 citations · 5 across the 2 of their papers we have counts for

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2 papers

physics.chem-ph2025★ 1 cited

Efficient Implementation of the Spin-Free Renormalized Internally-Contracted Multireference Coupled Cluster Theory

Kalman Szenes, Riya Kayal, Kantharuban Sivalingam +3

In this paper, an efficient implementation of the renormalized internally-contracted multreference coupled cluster with singles and doubles (RIC-MRCCSD) into the ORCA quantum chemi…

physics.chem-ph2020★ 4 cited

Exploration of interlacing and avoided crossings in a manifold of potential energy curves by a Unitary Group Adapted State Specific Multi-Reference Perturbation Theory (UGA-SSMRPT)

Dibyajyoti Chakravarti, Koustav Hazra, Riya Kayal +2

The Unitary Group Adapted State-Specific Multi-Reference Perturbation Theory (UGA-SSMRPT2) developed by Mukherjee et al [J. Comput. Chem. 2015, 36, 670] has successfully realized t…