Justin M. Turney

Open Medicine Institute — United States

Physics and Astronomy · Physical Sciences

20h-index4.7kcitations102works0.82yr avg
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Research Topics

Advanced Chemical Physics Studies(61), Atmospheric chemistry and aerosols(21), Atmospheric Ozone and Climate(15), Spectroscopy and Quantum Chemical Studies(14), Inorganic Fluorides and Related Compounds(12)

Publications102 total

Einsums/Einsums: v1.1.2
Zenodo (CERN European Organization for Nuclear Research)·2026Open Access
Vibrational Signatures of Unrealized Phosphorus Suboxide Intermediates in White Phosphorus Oxidation Reactions
The Journal of Physical Chemistry A·2025Open Access
Methods in PES-Learn: Direct-Fit Machine Learning of Born–Oppenheimer Potential Energy Surfaces
Molecules·2025Open Access
Local Pair Natural Orbital-based Coupled-Cluster Theory through Full Quadruples (DLPNO-CCSDTQ)
2025Open Access
The Remarkable I<sub>2</sub>O<sub>3</sub> Molecule: A New View from Theory
The Journal of Physical Chemistry A·2025Open Access
Giant Dipole Moments: Remarkable Effects Mono‐, Di‐, and Tri‐ Hydrated 5,6‐Diaminobenzene‐1,2,3,4‐Tetracarbonnitrile
Journal of Computational Chemistry·2025Open Access
Linear-scaling quadruple excitations in local pair natural orbital coupled-cluster theory
The Journal of Chemical Physics·2025· 1 cited
Linear-Scaling Quadruple Excitations in Local Pair Natural Orbital Coupled-Cluster Theory
2025Open Access
Linear-Scaling Local Natural Orbital-Based Full Triples Treatment in Coupled-Cluster Theory
Journal of Chemical Theory and Computation·2025· 5 citedOpen Access
Linear-Scaling Quadruple Excitations in Local Pair Natural Orbital Coupled-Cluster Theory
2025Open Access
Giant Dipole Moments: Remarkable Effect of Single Solvent Molecules on 5, 6- Diaminobenzene-1,2,3,4-Tetracarbonnitrile
2025Open Access
Linear-Scaling Local Natural Orbital-based Full Triples Treatment in Coupled-Cluster Theory
2024Open Access
Evaluating the Importance of Conformers for Understanding the Vacuum-Ultraviolet Spectra of Oxiranes: Experiment and Theory
The Journal of Physical Chemistry A·2024· 1 citedOpen Access
Automatic Differentiation for Explicitly Correlated MP2
Journal of Chemical Theory and Computation·2024· 1 citedOpen Access
Accurate and efficient open-source implementation of domain-based local pair natural orbital (DLPNO) coupled-cluster theory using a t1-transformed Hamiltonian
The Journal of Chemical Physics·2024· 7 cited
Comparative Study of Neutral and Cationic Sn<sub>2</sub>H<sub>2</sub>: Toward Laboratory Detection of the Cation
The Journal of Physical Chemistry A·2024Open Access
<scp>MolSym</scp>: A Python package for handling symmetry in molecular quantum chemistry
The Journal of Chemical Physics·2024· 1 citedOpen Access
Ethynyl Radical Hydrogen Abstraction Energetics and Kinetics Utilizing High-Level Theory
ACS Earth and Space Chemistry·2024· 1 citedOpen Access
Accurate and Efficient Open-Source Implementation of Domain-Based Local Pair Natural Orbital (DLPNO) Coupled-Cluster Theory Using a t1-Transformed Hamiltonian
2024· 1 citedOpen Access
Pb <sub>2</sub> H <sub>2</sub> <sup>+</sup> : convergent quantum mechanical study of seven lead hydride cation structures. Toward laboratory identification
Molecular Physics·2024
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Frequent Co-authors

Henry F. Schaefer(50), C. David Sherrill(12), Lori A. Burns(9), Daniel G. A. Smith(9), Andrew C. Simmonett(9), Rollin A. King(9), Francesco A. Evangelista(8), Adam S. Abbott(8), A. Eugene DePrince(7), Uğur Bozkaya(7), Andrew M. James(7), Ashutosh Kumar(7), Konrad Patkowski(7), Jonathon P. Misiewicz(7), Jeffrey B. Schriber(7), Edward G. Hohenstein(6), Alexander Yu. Sokolov(6), T. Daniel Crawford(6), Dominic A. Sirianni(6), Yukio Yamaguchi(6)