Dhabih V. Chulhai

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Lasse JensenProfessor of Chemistry, Penn StateVerified email at chem.psu.edu
Jason GoodpasterUniversity of Minnesota Twin CitiesVerified email at umn.edu
Richard P. Van Duyne OR Richard P....Northwestern UniversityVerified email at northwestern.edu
Xuelan WenPrinceton UniversityVerified email at princeton.edu
Daniel S. GrahamGraduate Student of Chemistry, University of MinnesotaVerified email at umn.edu
Mark HersamNorthwestern UniversityVerified email at northwestern.edu
Nan JiangAssociate Professor, Department of Chemistry & Department of Physics, University of Illinois ChicagoVerified email at uic.edu
Xing ChenInstitute of Molecular Plus, Tianjin UniversityVerified email at tju.edu.cn
Matthew SonntagAlbright CollegeVerified email at albright.edu
Naihao ChiangUniversity of HoustonVerified email at uh.edu
Guillaume GoubertUniversité du Québec à MontréalVerified email at uqam.ca
Pengchong LiuThe Pennsylvania State UniversityVerified email at psu.edu
Zhongwei HuKebotix, Inc.Verified email at kebotix.com
Evert Jan BaerendsProfessor of Theoretical Chemistry, Vrije Universiteit, AmsterdamVerified email at vu.nl
Jochen AutschbachProfessor of Chemistry, University at Buffalo, State University of New YorkVerified email at buffalo.edu
Stan van GisbergenCEO of Software for Chemistry & MaterialsVerified email at scm.com
Andreas GoetzSan Diego Supercomputer CenterVerified email at sdsc.edu
F.Matthias BickelhauptVU University AmsterdamVerified email at vu.nl
Xu ChenMax-plank institute for solid state researchVerified email at fkf.mpg.de
Gyeongwon (Kevin) KangAssistant Professor, Kangwon National UniversityVerified email at kangwon.ac.kr

Dhabih V. Chulhai

Assistant Professor of Chemistry, University of Indianapolis

Verified email at uindy.edu - Homepage

Density Functional Theory Electronic Structure Machine Learning Surface-Enhanced Spectroscopy Chemical Education


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ADF2016, SCM. 2016; Theoretical Chemistry, Vrije Universiteit, Amsterdam, The Netherlands EJ Baerends, T Ziegler, AJ Atkins, J Autschbach, D Bashford, O Baseggio, ...	892*	2016
Intramolecular Insight into Adsorbate–Substrate Interactions via Low-Temperature, Ultrahigh-Vacuum Tip-Enhanced Raman Spectroscopy JM Klingsporn, N Jiang, EA Pozzi, MD Sonntag, DV Chulhai, T Seideman, ... Journal of the American Chemical Society 136 (10), 3881-3887, 2014	155	2014
Single-molecule imaging using atomistic near-field tip-enhanced Raman spectroscopy P Liu, DV Chulhai, L Jensen ACS nano 11 (5), 5094-5102, 2017	125	2017
Conformational contrast of surface-mediated molecular switches yields Ångstrom-scale spatial resolution in ultrahigh vacuum tip-enhanced Raman spectroscopy N Chiang, X Chen, G Goubert, DV Chulhai, X Chen, EA Pozzi, N Jiang, ... Nano letters 16 (12), 7774-7778, 2016	125	2016
The Origin of Relative Intensity Fluctuations in Single-Molecule Tip-Enhanced Raman Spectroscopy MD Sonntag, DV Chulhai, T Seideman, L Jensen, RP Van Duyne Journal of the American Chemical Society 135 (45), 17187-17192, 2013	117	2013
Molecular-Resolution Interrogation of a Porphyrin Monolayer by Ultrahigh Vacuum Tip-Enhanced Raman and Fluorescence Spectroscopy N Chiang, N Jiang, DV Chulhai, EA Pozzi, MC Hersam, L Jensen, ... Nano letters 15 (6), 4114--4120, 2015	103	2015
Projection-Based Correlated Wave Function in Density Functional Theory Embedding for Periodic Systems DV Chulhai, JD Goodpaster Journal of Chemical Theory and Computation 14 (4), 1928-1942, 2018	101	2018
Determining Molecular Orientation with Surface-Enhanced Raman Scattering Using Inhomogenous Electric Fields DV Chulhai, L Jensen The Journal of Physical Chemistry C 117 (38), 19622-19631, 2013	99	2013
Tip-Enhanced Raman Voltammetry: Coverage Dependence and Quantitative Modeling M Mattei, G Kang, G Goubert, DV Chulhai, GC Schatz, L Jensen, ... Nano Letters 17 (1), 590-596, 2017	90	2017
Theory of Linear and Nonlinear Surface-Enhanced Vibrational Spectroscopy DV Chulhai, Z Hu, JE Moore, X Chen, L Jensen Annual Review of Physical Chemistry 67 (1), 541-564, 2016	66	2016
Absolutely Localized Projection-Based Embedding for Excited States X Wen, DS Graham, DV Chulhai, JD Goodpaster Journal of Chemical Theory and Computation, 2019	65	2019
Improved Accuracy and Efficiency in Quantum Embedding through Absolute Localization DV Chulhai, JD Goodpaster Journal of Chemical Theory and Computation 13 (4), 1503-1508, 2017	62	2017
Toward monitoring electrochemical reactions with dual-wavelength SERS: Characterization of rhodamine 6G (R6G) neutral radical species and covalent tethering of R6G to silver … S Zaleski, MF Cardinal, DV Chulhai, AJ Wilson, KA Willets, L Jensen, ... The Journal of Physical Chemistry C 120 (43), 24982-24991, 2016	44	2016
Simulating ensemble-averaged surface-enhanced Raman scattering DV Chulhai, X Chen, L Jensen The Journal of Physical Chemistry C 120 (37), 20833-20842, 2016	41	2016
External Orthogonality in Subsystem Time-Dependent Density Functional Theory DV Chulhai, L Jensen Physical Chemistry Chemical Physics 18, 21032-21039, 2016	41	2016
Frozen Density Embedding with External Orthogonality in Delocalized Covalent Systems DV Chulhai, L Jensen Journal of Chemical Theory and Computation 11 (7), 3080-3088, 2015	36	2015
Simulating Surface-Enhanced Hyper-Raman Scattering Using Atomistic Electrodynamics-Quantum Mechanical Models Z Hu, DV Chulhai, L Jensen Journal of Chemical Theory and Computation 12 (12), 5968-5978, 2016	35	2016
Simulating Surface-Enhanced Raman Optical Activity Using Atomistic Electrodynamics-Quantum Mechanical Models DV Chulhai, L Jensen The Journal of Physical Chemistry A 118 (39), 9069-9079, 2014	33	2014
Robust, Accurate, and Efficient: Quantum Embedding Using the Huzinaga Level-Shift Projection Operator for Complex Systems DS Graham, X Wen, DV Chulhai, JD Goodpaster Journal of Chemical Theory and Computation 16 (4), 2284-2295, 2020	23	2020
Plasmon-driven C–N bond cleavage across a series of viologen derivatives JL Brooks, DV Chulhai, Z Yu, JD Goodpaster, RR Frontiera The Journal of Physical Chemistry C 123 (48), 29306-29313, 2019	16	2019

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