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Tanner Culpitt - Publications

Affiliations: 
2019 Chemistry University of Illinois, Urbana-Champaign, Urbana-Champaign, IL 
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14 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2023 Tellgren EI, Culpitt T, Peters LDM, Helgaker T. Molecular vibrations in the presence of velocity-dependent forces. The Journal of Chemical Physics. 158: 124124. PMID 37003779 DOI: 10.1063/5.0139684  0.318
2023 Culpitt T, Peters LDM, Tellgren EI, Helgaker T. Time-dependent nuclear-electronic orbital Hartree-Fock theory in a strong uniform magnetic field. The Journal of Chemical Physics. 158: 114115. PMID 36948801 DOI: 10.1063/5.0139675  0.372
2022 Peters LDM, Culpitt T, Tellgren EI, Helgaker T. Magnetic-translational sum rule and approximate models of the molecular Berry curvature. The Journal of Chemical Physics. 157: 134108. PMID 36208997 DOI: 10.1063/5.0112943  0.408
2020 Pavosevic F, Tao Z, Culpitt T, Zhao L, Li X, Hammes-Schiffer S. Frequency and Time Domain Nuclear-Electronic Orbital Equation-of-Motion Coupled Cluster Methods: Combination Bands and Electronic-Protonic Double Excitations. The Journal of Physical Chemistry Letters. PMID 32658486 DOI: 10.1021/Acs.Jpclett.0C01891  0.655
2020 Pavošević F, Culpitt T, Hammes-Schiffer S. Multicomponent Quantum Chemistry: Integrating Electronic and Nuclear Quantum Effects via the Nuclear-Electronic Orbital Method. Chemical Reviews. PMID 32283015 DOI: 10.1021/Acs.Chemrev.9B00798  0.713
2019 Culpitt T, Yang Y, Schneider PE, Pavosevic F, Hammes-Schiffer S. Molecular Vibrational Frequencies with Multiple Quantum Protons within the Nuclear-Electronic Orbital Framework. Journal of Chemical Theory and Computation. PMID 31618582 DOI: 10.1021/Acs.Jctc.9B00665  0.707
2019 Culpitt T, Yang Y, Pavošević F, Tao Z, Hammes-Schiffer S. Enhancing the applicability of multicomponent time-dependent density functional theory. The Journal of Chemical Physics. 150: 201101. PMID 31153172 DOI: 10.1063/1.5099093  0.74
2019 Yang Y, Schneider PE, Culpitt T, Pavosevic F, Hammes-Schiffer S. Molecular Vibrational Frequencies within the Nuclear-Electronic Orbital Framework. The Journal of Physical Chemistry Letters. PMID 30776246 DOI: 10.1021/Acs.Jpclett.9B00299  0.696
2018 Pavošević F, Culpitt T, Hammes-Schiffer S. Multicomponent Coupled Cluster Singles and Doubles Theory within the Nuclear-Electronic Orbital Framework. Journal of Chemical Theory and Computation. PMID 30525610 DOI: 10.1021/Acs.Jctc.8B01120  0.688
2018 Yang Y, Culpitt T, Tao Z, Hammes-Schiffer S. Stability conditions and local minima in multicomponent Hartree-Fock and density functional theory. The Journal of Chemical Physics. 149: 084105. PMID 30193501 DOI: 10.1063/1.5040353  0.658
2018 Yang Y, Culpitt T, Hammes-Schiffer S. Multicomponent Time-Dependent Density Functional Theory: Proton and Electron Excitation Energies. The Journal of Physical Chemistry Letters. PMID 29553738 DOI: 10.1021/Acs.Jpclett.8B00547  0.707
2017 Yang Y, Brorsen KR, Culpitt T, Pak MV, Hammes-Schiffer S. Development of a practical multicomponent density functional for electron-proton correlation to produce accurate proton densities. The Journal of Chemical Physics. 147: 114113. PMID 28938833 DOI: 10.1063/1.4996038  0.634
2017 Culpitt T, Brorsen KR, Hammes-Schiffer S. Communication: Density functional theory embedding with the orthogonality constrained basis set expansion procedure. The Journal of Chemical Physics. 146: 211101. PMID 28576084 DOI: 10.1063/1.4984777  0.536
2016 Culpitt T, Brorsen KR, Pak MV, Hammes-Schiffer S. Multicomponent density functional theory embedding formulation. The Journal of Chemical Physics. 145: 044106. PMID 27475347 DOI: 10.1063/1.4958952  0.635
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