Samuel J Stoneburner

2PUBLICATIONS
3CO-AUTHORS
Theoretical quantum chemistry
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Publications (2)

|Feb 17, 2018
MC-PDFT can calculate singlet-triplet splittings of organic diradicals.

Samuel J Stoneburner, Donald G Truhlar, Laura Gagliardi

|Nov 04, 2017
Systematic design of active spaces for multi-reference calculations of singlet-triplet gaps of organic diradicals, with benchmarks against doubly electron-attached coupled-cluster data.

Samuel J Stoneburner, Jun Shen, Adeayo O Ajala

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Frequent Collaborators

2 joint publications

Donald G Truhlar

2 joint publications

Laura Gagliardi

1 joint publications

Piotr Piecuch