Hanna Reisler - Related publications

Chemistry (Chemical Physics): Doctor of Philosophy University of Southern California, Los Angeles, CA, United States 
Physical Chemistry
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50 most relevant papers in past 60 days:
Year Citation  Score
2019 Qian CH, Zhu GZ, Wang LS. Probing the Critical Dipole Moment to Support Excited Dipole-Bound States in Valence-Bound Anions. The Journal of Physical Chemistry Letters. PMID 31589447 DOI: 10.1021/acs.jpclett.9b02679   
2019 Liu Y, Gong T, Ji Z, Wang G, Zhao Y, Xiao L, Jia S. Production of ultracold RbCs molecules in the lowest ground state via the BΠ short-range state. The Journal of Chemical Physics. 151: 084303. PMID 31470716 DOI: 10.1063/1.5108637   
2019 Chin CH, Zhu T, Zhang JZH. Formation mechanism and spectroscopy of CH radicals in extreme environments: a theoretical study. Physical Chemistry Chemical Physics : Pccp. PMID 31599891 DOI: 10.1039/c9cp03662h   
2019 Maulén B, Echeverri A, Gomez T, Fuentealba P, Cardenas C. The Electron Localization Function in Excited States: The case of the ultra-fast proton transfer of the salicylidene methylamine. Journal of Chemical Theory and Computation. PMID 31461279 DOI: 10.1021/acs.jctc.9b00691   
2019 Blodgett KN, Sun D, Fischer JL, Sibert EL, Zwier TS. Vibronic spectroscopy of methyl anthranilate and its water complex: hydrogen atom dislocation in the excited state. Physical Chemistry Chemical Physics : Pccp. PMID 31531502 DOI: 10.1039/c9cp04556b   
2019 Engin S, González-Vázquez J, Maliyar GG, Milosavljević AR, Ono T, Nandi S, Iablonskyi D, Kooser K, Bozek JD, Decleva P, Kukk E, Ueda K, Martín F. Full-dimensional theoretical description of vibrationally resolved valence-shell photoionization of HO. Structural Dynamics (Melville, N.Y.). 6: 054101. PMID 31531387 DOI: 10.1063/1.5106431   
2019 Castro-Juárez E, Wang XG, Carrington T, Quintas-Sánchez E, Dawes R. Computational study of the ro-vibrational spectrum of CO-CO. The Journal of Chemical Physics. 151: 084307. PMID 31470713 DOI: 10.1063/1.5119762   
2019 Ghosh S, Sharma R, Adhikari S, Varandas AJC. Fully coupled (J > 0) time-dependent wave-packet calculations using hyperspherical coordinates for the H + O reaction on the CHIPR potential energy surface. Physical Chemistry Chemical Physics : Pccp. PMID 31483425 DOI: 10.1039/c9cp03171e   
2019 Yang D, Huang J, Hu X, Guo H, Xie D. Breakdown of energy transfer gap laws revealed by full-dimensional quantum scattering between HF molecules. Nature Communications. 10: 4658. PMID 31604950 DOI: 10.1038/s41467-019-12691-8   
2019 Zhang L, Jiang B. Efficient Vibrational Energy Redistribution between Stretching Modes: State-to-State Quantum Scattering of H_{2}O from Cu(111). Physical Review Letters. 123: 106001. PMID 31573276 DOI: 10.1103/PhysRevLett.123.106001   
2019 Ascenzi D, Romanzin C, Lopes A, Tosi P, Žabka J, Polášek M, Shaffer CJ, Alcaraz C. State-Selected Reactivity of Carbon Dioxide Cations ( ) With Methane. Frontiers in Chemistry. 7: 537. PMID 31428598 DOI: 10.3389/fchem.2019.00537   
2019 Badreddine K, Korek M. Electronic Structure with Dipole Moment and Rovibrational Calculation of Cadmium Chalcogenide Molecules CdX (X = Se, Te). Acs Omega. 4: 920-931. PMID 31459368 DOI: 10.1021/acsomega.8b01306   
2019 Myhre RH, Coriani S, Koch H. X-ray and UV Spectra of Glycine within Coupled Cluster Linear Response Theory. The Journal of Physical Chemistry. A. PMID 31549830 DOI: 10.1021/acs.jpca.9b06590   
2019 Kidwell NM, Nebgen B, Slipchenko LV, Zwier TS. The effects of site asymmetry on near-degenerate state-to-state vibronic mixing in flexible bichromophores. The Journal of Chemical Physics. 151: 084313. PMID 31470719 DOI: 10.1063/1.5107423   
2019 Hua W, Mukamel S, Luo Y. Transient X-ray Absorption Spectral Fingerprints of the S Dark State in Uracil. The Journal of Physical Chemistry Letters. PMID 31625754 DOI: 10.1021/acs.jpclett.9b02692   
2019 Fang C, Durbeej B. Calculation of Free-Energy Barriers with TD-DFT: A Case Study on Excited-State Proton Transfer in Indigo. The Journal of Physical Chemistry. A. PMID 31513399 DOI: 10.1021/acs.jpca.9b05163   
2019 Nikoobakht B, Dreuw A, Köppel H. Excited state dynamics of the s-trans-1, 3-butadiene cation: An ab initio quantum dynamical analysis. The Journal of Chemical Physics. 151: 104105. PMID 31521078 DOI: 10.1063/1.5108610   
2019 Hafliðason A, Jiang MX, Kvaran Á. High energy Rydberg and ion-pair states, state mixing and excitation dynamics of HI. Physical Chemistry Chemical Physics : Pccp. PMID 31612169 DOI: 10.1039/c9cp04872c   
2019 Masuda T, Yoshimi A, Fujieda A, Fujimoto H, Haba H, Hara H, Hiraki T, Kaino H, Kasamatsu Y, Kitao S, Konashi K, Miyamoto Y, Okai K, Okubo S, Sasao N, et al. X-ray pumping of the Th nuclear clock isomer. Nature. 573: 238-242. PMID 31511686 DOI: 10.1038/s41586-019-1542-3   
2019 Adams C, Hansen K, Weber JM. Vibrational Autodetachment from Anionic Nitroalkane Chains - From Molecular Signatures to Thermionic Emission. The Journal of Physical Chemistry. A. PMID 31532673 DOI: 10.1021/acs.jpca.9b07780   
2019 Mondal S, Narayana C. Role of Explicit Solvation in the Simulation of Resonance Raman Spectra within Short-Time Dynamics Approximation. The Journal of Physical Chemistry. B. PMID 31408344 DOI: 10.1021/acs.jpcb.9b07471   
2019 Palmer MH, Hoffmann SV, Jones NC, Coreno M, de Simone M, Grazioli C. The electronically excited states of cyclooctatetraene-An analysis of the vacuum ultraviolet absorption spectrum by ab initio configuration interaction methods. The Journal of Chemical Physics. 151: 084304. PMID 31470696 DOI: 10.1063/1.5115997   
2019 Ruddock JM, Yong H, Stankus B, Du W, Goff N, Chang Y, Odate A, Carrascosa AM, Bellshaw D, Zotev N, Liang M, Carbajo S, Koglin J, Robinson JS, Boutet S, et al. A deep UV trigger for ground-state ring-opening dynamics of 1,3-cyclohexadiene. Science Advances. 5: eaax6625. PMID 31523713 DOI: 10.1126/sciadv.aax6625   
2019 Mackrodt W, Rerat M, Gentile FS, Dovesi R. An all-electron study of the low-lying excited states and optical constants of Al2O3 in the range 5-80 eV. Journal of Physics. Condensed Matter : An Institute of Physics Journal. PMID 31593933 DOI: 10.1088/1361-648X/ab4c0e   
2019 Grotjahn R, Furche F, Kaupp M. Development and Implementation of Excited-State Gradients for Local Hybrid Functionals. Journal of Chemical Theory and Computation. PMID 31465223 DOI: 10.1021/acs.jctc.9b00659   
2019 Paul AC, Sharma K, Reza MA, Telfah H, Miller TA, Liu J. Laser-induced fluorescence and dispersed-fluorescence spectroscopy of the ÃE-X̃A transition of jet-cooled calcium methoxide (CaOCH) radicals. The Journal of Chemical Physics. 151: 134303. PMID 31594358 DOI: 10.1063/1.5104278   
2019 Ling F, Liu D, Li S, Li W, Zhang B, Wang P. Femtosecond real-time probing of the excited-state intramolecular proton transfer reaction in methyl salicylate. The Journal of Chemical Physics. 151: 094302. PMID 31492073 DOI: 10.1063/1.5115307   
2019 Bartlett MA, Kazez AH, Schaefer HF, Allen WD. Riddles of the structure and vibrational dynamics of HO resolved near the ab initio limit. The Journal of Chemical Physics. 151: 094304. PMID 31492062 DOI: 10.1063/1.5110291   
2019 Taffet EJ, Lee BG, Toa ZSD, Pace N, Rumbles G, Southall J, Cogdell RJ, Scholes GD. Carotenoid Nuclear Reorganization and Interplay of Bright and Dark Excited States. The Journal of Physical Chemistry. B. PMID 31553605 DOI: 10.1021/acs.jpcb.9b04027   
2019 Cheng L. A study of non-iterative triples contributions in relativistic equation-of-motion coupled-cluster calculations using an exact two-component Hamiltonian with atomic mean-field spin-orbit integrals: Application to uranyl and other heavy-element compounds. The Journal of Chemical Physics. 151: 104103. PMID 31521080 DOI: 10.1063/1.5113796   
2019 Sapunar M, Domcke W, Došlić N. UV absorption spectra of DNA bases in the 350-190 nm range: assignment and state specific analysis of solvation effects. Physical Chemistry Chemical Physics : Pccp. PMID 31595896 DOI: 10.1039/c9cp04662c   
2019 Liu Q, Zhang Y, Zhang Q, Wei Q, Zhou D, Wu G, Cai K, Yuan K, Bian H. Understanding the intramolecular vibrational energy transfer and structural dynamics of anionic ligands in a photo-catalytic CO reduction catalyst. Physical Chemistry Chemical Physics : Pccp. PMID 31599895 DOI: 10.1039/c9cp05029a   
2019 Qin XL, Zhu XL, Cao JW, Jiang L, Gu Y, Wang XC, Zhang P. Computational Analysis of Exotic Molecular and Atomic Vibrations in Ice XV. Molecules (Basel, Switzerland). 24. PMID 31461964 DOI: 10.3390/molecules24173115   
2019 Harms JC, O'Brien LC, O'Brien JJ. Mass-independent Dunham analysis of the known electronic states of platinum sulfide, PtS, and analysis of the electronic field-shift effect. The Journal of Chemical Physics. 151: 094303. PMID 31492063 DOI: 10.1063/1.5113510   
2019 Nandipati KR, Kanakati AK, Singh H, Mahapatra S. Controlled intramolecular H-transfer in malonaldehyde in the electronic ground state mediated through the conical intersection of nπ* and ππ* excited electronic states. Physical Chemistry Chemical Physics : Pccp. PMID 31478035 DOI: 10.1039/c9cp03762d   
2019 Holroyd RA, Miller JR. Rate vs Free Energy Change for Attaching Highly-Mobile Electrons to Molecules in Nonpolar Liquids. The Journal of Physical Chemistry. B. PMID 31594307 DOI: 10.1021/acs.jpcb.9b07845   
2019 Yong H, Ruddock JM, Stankus B, Ma L, Du W, Goff N, Chang Y, Zotev N, Bellshaw D, Boutet S, Carbajo S, Koglin JE, Liang M, Robinson JS, Kirrander A, et al. Scattering off molecules far from equilibrium. The Journal of Chemical Physics. 151: 084301. PMID 31470697 DOI: 10.1063/1.5111979   
2019 Hait D, Rettig A, Head-Gordon M. Beyond the Coulson-Fischer point: characterizing single excitation CI and TDDFT for excited states in single bond dissociations. Physical Chemistry Chemical Physics : Pccp. 21: 21761-21775. PMID 31552963 DOI: 10.1039/c9cp04452c   
2019 Svoboda V, Wang C, Waters MDJ, Wörner HJ. Electronic and vibrational relaxation dynamics of NH Rydberg states probed by vacuum-ultraviolet time-resolved photoelectron imaging. The Journal of Chemical Physics. 151: 104306. PMID 31521079 DOI: 10.1063/1.5116707   
2019 Brumboiu IE, Eriksson O, Norman P. Photoelectron Spectroscopy of Molecules Beyond the Electric Dipole Approximation. Journal of Chemical Theory and Computation. PMID 31509709 DOI: 10.1021/acs.jctc.9b00470   
2019 Davis MM, Weidman JD, Abbott AS, Douberly GE, Turney JM, Schaefer HF. Characterization of the 2-methylvinoxy radical + O reaction: A focal point analysis and composite multireference study. The Journal of Chemical Physics. 151: 124302. PMID 31575204 DOI: 10.1063/1.5113800   
2019 Yin R, Zhang Y, Jiang B. Strong Vibrational Relaxation of NO Scattered from Au(111): Importance of the Adiabatic Potential Energy Surface. The Journal of Physical Chemistry Letters. PMID 31538787 DOI: 10.1021/acs.jpclett.9b01806   
2019 Blancafort-Jorquera M, Vilà A, González M. Rotational energy relaxation quantum dynamics of a diatomic molecule in a superfluid helium nanodroplet and study of the hydrogen isotopes case. Physical Chemistry Chemical Physics : Pccp. PMID 31528895 DOI: 10.1039/c9cp00952c   
2019 Chakraborty D, Giri A, Nandi D. Dissociation dynamics in low energy electron attachment to ammonia using velocity slice imaging. Physical Chemistry Chemical Physics : Pccp. PMID 31553032 DOI: 10.1039/c9cp03973b   
2019 Wang XD, Robertson PA, Cascarini FJJ, Quinn MS, McManus JW, Orr-Ewing AJ. Observation of Rainbows in the Rotationally Inelastic Scattering of NO With CH. The Journal of Physical Chemistry. A. PMID 31442046 DOI: 10.1021/acs.jpca.9b06806   
2019 Xiong T, Saalfrank P. Vibrationally Broadened Optical Spectra of Selected Radicals and Cations Derived from Adamantane: A Time-dependent Correlation Function Approach. The Journal of Physical Chemistry. A. PMID 31536349 DOI: 10.1021/acs.jpca.9b03305   
2019 Majer K, Signorell R, Heringa MF, Goldmann M, Hemberger P, Bodi A. Valence Photoionization of Thymine: Ionization Energies, Vibrational Structure, and Fragmentation Pathways from the Slow to the Ultrafast. Chemistry (Weinheim An Der Bergstrasse, Germany). PMID 31469456 DOI: 10.1002/chem.201903282   
2019 Burton MA, Russ BT, Bucchino MP, Sheridan PM, Ziurys LM. The ground state of KO revisited: the millimeter and submillimeter spectrum of potassium oxide. Physical Chemistry Chemical Physics : Pccp. PMID 31552946 DOI: 10.1039/c9cp03465j   
2019 Barclay MS, Caricato M, Elles CG. Femtosecond Stimulated Raman Scattering from Triplet Electronic States: Experimental and Theoretical Study of Resonance Enhancements. The Journal of Physical Chemistry. A. PMID 31423781 DOI: 10.1021/acs.jpca.9b05955   
2019 Seiferle B, von der Wense L, Bilous PV, Amersdorffer I, Lemell C, Libisch F, Stellmer S, Schumm T, Düllmann CE, Pálffy A, Thirolf PG. Energy of the Th nuclear clock transition. Nature. 573: 243-246. PMID 31511684 DOI: 10.1038/s41586-019-1533-4