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Shashank Vittal Rao

4PUBLICATIONS

8CO-AUTHORS

Atomic and molecular physicsComputational chemistryMain group metal chemistryIntegrable systems (classical and quantum)

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Publications (4)

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|Oct 13, 2025

A reflection on modelling and examination of paramagnetic molecules for magnetic storage and molecular spintronics.

Mihail Atanasov, Shashank Vittal Rao, Frank Neese

|Dec 19, 2024

Extended Active Space Ab Initio Ligand Field Theory: Applications to Transition-Metal Ions.

Shashank V Rao, Dimitrios Maganas, Kantharuban Sivalingam

|Jun 16, 2023

Air-stable four-coordinate cobalt(ii) single-ion magnets: experimental and <i>ab initio</i> ligand field analyses of correlations between dihedral angles and magnetic anisotropy.

Sandeep K Gupta, Shashank V Rao, Serhiy Demeshko

|Apr 05, 2022

Study of the most relevant spin-orbit coupling descriptions of magnetic excitations in a series of lanthanide complexes.

Shashank Vittal Rao, Matteo Piccardo, Alessandro Soncini

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Frequent Collaborators

3 joint publications

Mihail Atanasov

3 joint publications

Frank Neese

1 joint publications

Sandeep K Gupta

1 joint publications

Sebastian Dechert

1 joint publications

Franc Meyer

1 joint publications

Dimitrios Maganas

1 joint publications

Matteo Piccardo

1 joint publications

Alessandro Soncini

Frequent Collaborators

3 joint publications

Mihail Atanasov

3 joint publications

Frank Neese

1 joint publications

Sandeep K Gupta

1 joint publications

Sebastian Dechert

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