| Year |
Citation |
Score |
| 2022 |
Graham DS, Wen X, Chulhai DV, Goodpaster JD. Huzinaga projection embedding for efficient and accurate energies of systems with localized spin-densities. The Journal of Chemical Physics. 156: 054112. PMID 35135248 DOI: 10.1063/5.0076493 |
0.743 |
|
| 2020 |
Brooks JL, Warkentin CL, Chulhai DV, Goodpaster JD, Frontiera RR. Plasmon-Mediated Intramolecular Methyl Migration with Nanoscale Spatial Control. Acs Nano. PMID 33296172 DOI: 10.1021/acsnano.0c07123 |
0.674 |
|
| 2020 |
Graham DS, Wen X, Chulhai DV, Goodpaster JD. Robust, accurate, and efficient: quantum embedding using the Huzinaga level-shift projection operator for complex systems. Journal of Chemical Theory and Computation. PMID 32105469 DOI: 10.1021/Acs.Jctc.9B01185 |
0.742 |
|
| 2019 |
Wen X, Graham DS, Chulhai DV, Goodpaster JD. Absolutely Localized Projection-Based Embedding for Excited States. Journal of Chemical Theory and Computation. PMID 31769981 DOI: 10.1021/Acs.Jctc.9B00959 |
0.746 |
|
| 2019 |
Brooks JL, Chulhai DV, Yu Z, Goodpaster JD, Frontiera RR. Plasmon-Driven C–N Bond Cleavage Across a Series of Viologen Derivatives The Journal of Physical Chemistry C. 123: 29306-29313. DOI: 10.1021/Acs.Jpcc.9B08179 |
0.695 |
|
| 2019 |
Liu P, Chulhai DV, Jensen L. Atomistic Characterization of Plasmonic Dimers in the Quantum Size Regime The Journal of Physical Chemistry C. 123: 13900-13907. DOI: 10.1021/Acs.Jpcc.9B02812 |
0.564 |
|
| 2018 |
Chulhai DV, Goodpaster JD. Projection-Based Correlated Wave Function in Density Functional Theory Embedding for Periodic Systems. Journal of Chemical Theory and Computation. PMID 29494155 DOI: 10.1021/Acs.Jctc.7B01154 |
0.695 |
|
| 2017 |
Liu P, Chulhai DV, Jensen L. Single-Molecule Imaging Using Atomistic Near-Field Tip-Enhanced Raman Spectroscopy. Acs Nano. PMID 28463555 DOI: 10.1021/Acsnano.7B02058 |
0.561 |
|
| 2017 |
Chulhai DV, Goodpaster JD. Improved Accuracy and Efficiency in Quantum Embedding through Absolute Localization. Journal of Chemical Theory and Computation. PMID 28263589 DOI: 10.1021/Acs.Jctc.7B00034 |
0.714 |
|
| 2016 |
Mattei M, Kang G, Goubert G, Chulhai DV, Schatz GC, Jensen L, Van Duyne RP. Tip-Enhanced Raman Voltammetry: Coverage Dependence and Quantitative Modeling. Nano Letters. PMID 27936805 DOI: 10.1021/Acs.Nanolett.6B04868 |
0.601 |
|
| 2016 |
Chiang N, Chen X, Goubert G, Chulhai DV, Chen X, Pozzi EA, Jiang N, Hersam MC, Seideman T, Jensen L, Van Duyne RP. Conformational Contrast of Surface-Mediated Molecular Switches Yields Angstrom-Scale Spatial Resolution in Ultrahigh Vacuum Tip-Enhanced Raman Spectroscopy. Nano Letters. PMID 27797525 DOI: 10.1021/Acs.Nanolett.6B03958 |
0.548 |
|
| 2016 |
Hu Z, Chulhai DV, Jensen L. Simulating Surface-Enhanced Hyper-Raman Scattering Using Atomistic Electrodynamics-Quantum Mechanical Models. Journal of Chemical Theory and Computation. PMID 27792337 DOI: 10.1021/Acs.Jctc.6B00940 |
0.611 |
|
| 2016 |
Chulhai DV, Hu Z, Moore JE, Chen X, Jensen L. Theory of Linear and Nonlinear Surface-Enhanced Vibrational Spectroscopies. Annual Review of Physical Chemistry. PMID 27090843 DOI: 10.1146/Annurev-Physchem-040215-112347 |
0.531 |
|
| 2016 |
Chulhai DV, Jensen L. External orthogonality in subsystem time-dependent density functional theory. Physical Chemistry Chemical Physics : Pccp. PMID 26932176 DOI: 10.1039/C6Cp00310A |
0.591 |
|
| 2016 |
Zaleski S, Cardinal MF, Chulhai DV, Wilson AJ, Willets KA, Jensen L, Van Duyne RP. Toward Monitoring Electrochemical Reactions with Dual-Wavelength SERS: Characterization of Rhodamine 6G (R6G) Neutral Radical Species and Covalent Tethering of R6G to Silver Nanoparticles The Journal of Physical Chemistry C. 120: 24982-24991. DOI: 10.1021/Acs.Jpcc.6B09022 |
0.555 |
|
| 2016 |
Chulhai DV, Chen X, Jensen L. Simulating Ensemble-Averaged Surface-Enhanced Raman Scattering Journal of Physical Chemistry C. 120: 20833-20842. DOI: 10.1021/Acs.Jpcc.6B02159 |
0.561 |
|
| 2015 |
Chulhai DV, Jensen L. Frozen Density Embedding with External Orthogonality in Delocalized Covalent Systems. Journal of Chemical Theory and Computation. 11: 3080-8. PMID 26575744 DOI: 10.1021/Acs.Jctc.5B00293 |
0.592 |
|
| 2015 |
Chiang N, Jiang N, Chulhai DV, Pozzi EA, Hersam MC, Jensen L, Seideman T, Van Duyne RP. Molecular-Resolution Interrogation of a Porphyrin Monolayer by Ultrahigh Vacuum Tip-Enhanced Raman and Fluorescence Spectroscopy. Nano Letters. 15: 4114-20. PMID 25938625 DOI: 10.1021/Acs.Nanolett.5B01225 |
0.578 |
|
| 2015 |
Chulhai DV, Jensen L. Plasmonic circular dichroism of 310- and α-helix using a discrete interaction model/quantum mechanics method. The Journal of Physical Chemistry. A. 119: 5218-23. PMID 25474537 DOI: 10.1021/Jp5099188 |
0.499 |
|
| 2014 |
Chulhai DV, Jensen L. Simulating surface-enhanced Raman optical activity using atomistic electrodynamics-quantum mechanical models. The Journal of Physical Chemistry. A. 118: 9069-79. PMID 24834959 DOI: 10.1021/Jp502107F |
0.602 |
|
| 2014 |
Klingsporn JM, Jiang N, Pozzi EA, Sonntag MD, Chulhai D, Seideman T, Jensen L, Hersam MC, Van Duyne RP. Intramolecular insight into adsorbate-substrate interactions via low-temperature, ultrahigh-vacuum tip-enhanced Raman spectroscopy. Journal of the American Chemical Society. 136: 3881-7. PMID 24548252 DOI: 10.1021/Ja411899K |
0.563 |
|
| 2013 |
Sonntag MD, Chulhai D, Seideman T, Jensen L, Van Duyne RP. The origin of relative intensity fluctuations in single-molecule tip-enhanced Raman spectroscopy. Journal of the American Chemical Society. 135: 17187-92. PMID 24079659 DOI: 10.1021/Ja408758J |
0.589 |
|
| 2013 |
Chulhai DV, Jensen L. Determining Molecular Orientation With Surface-Enhanced Raman Scattering Using Inhomogenous Electric Fields The Journal of Physical Chemistry C. 117: 19622-19631. DOI: 10.1021/Jp4062626 |
0.528 |
|
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