Imaging a multidimensional multichannel potential energy surface: Photodetachment of H−(NH3) and NH4− (English)
- New search for: Hu, Qichi
- New search for: Song, Hongwei
- New search for: Johnson, Christopher J.
- New search for: Li, Jun
- New search for: Guo, Hua
- New search for: Continetti, Robert E.
- New search for: Hu, Qichi
- New search for: Song, Hongwei
- New search for: Johnson, Christopher J.
- New search for: Li, Jun
- New search for: Guo, Hua
- New search for: Continetti, Robert E.
In:
The Journal of Chemical Physics
;
144
, 24
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9
;
2016
- Article (Journal) / Electronic Resource
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Title:Imaging a multidimensional multichannel potential energy surface: Photodetachment of H−(NH3) and NH4−
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Contributors:Hu, Qichi ( author ) / Song, Hongwei ( author ) / Johnson, Christopher J. ( author ) / Li, Jun ( author ) / Guo, Hua ( author ) / Continetti, Robert E. ( author )
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Published in:The Journal of Chemical Physics ; 144, 24 ; 9
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Publisher:
- New search for: AIP Publishing LLC
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Publication date:2016-06-28
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Size:9 pages
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ISSN:
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DOI:
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Type of media:Article (Journal)
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Type of material:Electronic Resource
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Language:English
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Keywords:
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Source:
Table of contents – Volume 144, Issue 24
The tables of contents are generated automatically and are based on the data records of the individual contributions available in the index of the TIB portal. The display of the Tables of Contents may therefore be incomplete.
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On the existence of the optimal order for wavefunction extrapolation in Born-Oppenheimer molecular dynamicsFang, Jun / Gao, Xingyu / Song, Haifeng / Wang, Han et al. | 2016
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The electron localization as the information content of the conditional pair densityUrbina, Andres S. / Torres, F. Javier / Rincon, Luis et al. | 2016
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Exits in order: How crowding affects particle lifetimesPenington, Catherine J. / Baker, Ruth E. / Simpson, Matthew J. et al. | 2016
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Interpolation of property-values between electron numbers is inconsistent with ensemble averagingMiranda-Quintana, Ramón Alain / Ayers, Paul W. et al. | 2016
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Glass transition and stable glass formation of tetrachloromethaneChua, Y. Z. / Tylinski, M. / Tatsumi, S. / Ediger, M. D. / Schick, C. et al. | 2016
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Thermal gravitational separation of ternary mixture n-dodecane/isobutylbenzene/tetralin components in a porous mediumLarabi, Mohamed Aziz / Mutschler, Dimitri / Mojtabi, Abdelkader et al. | 2016
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Bond breaking in epoxy systems: A combined QM/MM approachBarr, Stephen A. / Kedziora, Gary S. / Ecker, Allison M. / Moller, James C. / Berry, Rajiv J. / Breitzman, Tim D. et al. | 2016
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On the widths of Stokes lines in Raman scattering from molecules adsorbed at metal surfaces and in molecular conduction junctionsGao, Yi / Galperin, Michael / Nitzan, Abraham et al. | 2016
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Long-range energy transport in photosystem IIRoden, Jan J. J. / Bennett, Doran I. G. / Whaley, K. Birgitta et al. | 2016
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Quantum Monte Carlo with variable spinsMelton, Cody A. / Bennett, M. Chandler / Mitas, Lubos et al. | 2016
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Singlet-paired coupled cluster theory for open shellsGomez, John A. / Henderson, Thomas M. / Scuseria, Gustavo E. et al. | 2016
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Communication: Visualization and spectroscopy of defects induced by dehydrogenation in individual silicon nanocrystalsKislitsyn, Dmitry A. / Mills, Jon M. / Kocevski, Vancho / Chiu, Sheng-Kuei / DeBenedetti, William J. I. / Gervasi, Christian F. / Taber, Benjamen N. / Rosenfield, Ariel E. / Eriksson, Olle / Rusz, Ján et al. | 2016
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A new set of potential energy surfaces for HCO: Influence of Renner-Teller coupling on the bound and resonance vibrational statesNdengué, Steve Alexandre / Dawes, Richard / Guo, Hua et al. | 2016
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Gas phase structures and charge localization in small aluminum oxide anions: Infrared photodissociation spectroscopy and electronic structure calculationsSong, Xiaowei / Fagiani, Matias R. / Gewinner, Sandy / Schöllkopf, Wieland / Asmis, Knut R. / Bischoff, Florian A. / Berger, Fabian / Sauer, Joachim et al. | 2016
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The melting of stable glasses is governed by nucleation-and-growth dynamicsJack, Robert L. / Berthier, Ludovic et al. | 2016
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Adsorbed states of chlorophenol on Cu(110) and controlled switching of single-molecule junctionsOkuyama, H. / Kitaguchi, Y. / Hattori, T. / Ueda, Y. / Ferrer, N. G. / Hatta, S. / Aruga, T. et al. | 2016
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Modeling surface motion effects in N2 dissociation on W(110): Ab initio molecular dynamics calculations and generalized Langevin oscillator modelNattino, Francesco / Galparsoro, Oihana / Costanzo, Francesca / Díez Muiño, Ricardo / Alducin, Maite / Kroes, Geert-Jan et al. | 2016
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Simulation of optical response functions in molecular junctionsGao, Yi / Galperin, Michael et al. | 2016
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Analyzing aging under oscillatory strain field through the soft glassy rheology modelKaushal, Manish / Joshi, Yogesh M. et al. | 2016
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Detection and characterization of singly deuterated silylene, SiHD, via optical spectroscopyKokkin, Damian L. / Ma, Tongmei / Steimle, Timothy / Sears, Trevor J. et al. | 2016
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A DFT investigation of the adsorption of iodine compounds and water in H-, Na-, Ag-, and Cu- mordeniteChibani, Siwar / Chebbi, Mouheb / Lebègue, Sébastien / Bučko, Tomáš / Badawi, Michael et al. | 2016
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NEXAFS spectroscopy and site-specific fragmentation of N-methylformamide, N,N-dimethylformamide, and N,N-dimethylacetamideSalén, Peter / Yatsyna, Vasyl / Schio, Luca / Feifel, Raimund / Richter, Robert / Alagia, Michele / Stranges, Stefano / Zhaunerchyk, Vitali et al. | 2016
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Transport properties and Stokes-Einstein relation in Al-rich liquid alloysJakse, N. / Pasturel, A. et al. | 2016
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Interruption of electronically excited Xe dimer formation by the photoassociation of Xe(6s[3/2]2)-Xe(5p6 1S0) thermal collision pairsGalvin, T. C. / Wagner, C. J. / Eden, J. G. et al. | 2016
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Imaging a multidimensional multichannel potential energy surface: Photodetachment of H−(NH3) and NH4−Hu, Qichi / Song, Hongwei / Johnson, Christopher J. / Li, Jun / Guo, Hua / Continetti, Robert E. et al. | 2016
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Communication: Proton NMR dipolar-correlation effect as a method for investigating segmental diffusion in polymer meltsLozovoi, A. / Mattea, C. / Herrmann, A. / Rössler, E. A. / Stapf, S. / Fatkullin, N. et al. | 2016
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Hubbard physics in the PAW GW approximationBooth, J. M. / Drumm, D. W. / Casey, P. S. / Smith, J. S. / Russo, S. P. et al. | 2016
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A minimalistic approach to static and dynamic electron correlations: Amending generalized valence bond method with extended random phase approximation correlation correctionChatterjee, Koushik / Pastorczak, Ewa / Jawulski, Konrad / Pernal, Katarzyna et al. | 2016
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Rate constants of chemical reactions from semiclassical transition state theory in full and one dimensionGreene, Samuel M. / Shan, Xiao / Clary, David C. et al. | 2016
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Effective interactions between nanoparticles: Creating temperature-independent solvation environments for self-assemblyYadav, Hari O. S. / Shrivastav, Gourav / Agarwal, Manish / Chakravarty, Charusita et al. | 2016
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Accelerating ring-polymer molecular dynamics with parallel-replica dynamicsLu, Chun-Yaung / Perez, Danny / Voter, Arthur F. et al. | 2016
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Auxiliary-field quantum Monte Carlo calculations of the molybdenum dimerPurwanto, Wirawan / Zhang, Shiwei / Krakauer, Henry et al. | 2016
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Microhydration of LiOH: Insight from electronic decays of core-ionized statesKryzhevoi, Nikolai V. et al. | 2016
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Comparative study of the Grüneisen parameter for 28 pure fluidsMausbach, Peter / Köster, Andreas / Rutkai, Gábor / Thol, Monika / Vrabec, Jadran et al. | 2016
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Non-resonant dynamic stark control of vibrational motion with optimized laser pulsesThomas, Esben F. / Henriksen, Niels E. et al. | 2016
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Electronic transitions of C5H+ and C5H: neon matrix and CASPT2 studiesFulara, Jan / Nagy, Adam / Chakraborty, Arghya / Maier, John P. et al. | 2016
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Phase reference in phase-sensitive sum-frequency vibrational spectroscopySun, Shumei / Liang, Rongda / Xu, Xiaofan / Zhu, Heyuan / Shen, Y. Ron / Tian, Chuanshan et al. | 2016
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Post-Hartree-Fock studies of the He/Mg(0001) interaction: Anti-corrugation, screening, and pairwise additivityde Lara-Castells, María Pilar / Fernández-Perea, Ricardo / Madzharova, Fani / Voloshina, Elena et al. | 2016
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On the properties of a bundle of flexible actin filaments in an optical trapPerilli, Alessia / Pierleoni, Carlo / Ciccotti, Giovanni / Ryckaert, Jean-Paul et al. | 2016
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Quantum dynamics of incoherently driven V-type systems: Analytic solutions beyond the secular approximationDodin, Amro / Tscherbul, Timur V. / Brumer, Paul et al. | 2016
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Coverage-dependent adsorption and desorption of oxygen on Pd(100)den Dunnen, Angela / Jacobse, Leon / Wiegman, Sandra / Berg, Otto T. / Juurlink, Ludo B. F. et al. | 2016
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Permeation of the three aromatic dipeptides through lipid bilayers: Experimental and computational studyLee, Brent L. / Kuczera, Krzysztof / Middaugh, C. Russell / Jas, Gouri S. et al. | 2016
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Evidence for concerted ring opening and C–Br bond breaking in UV-excited bromocyclopropanePandit, Shubhrangshu / Preston, Thomas J. / King, Simon J. / Vallance, Claire / Orr-Ewing, Andrew J. et al. | 2016
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Dissipative particle dynamics of diffusion-NMR requires high Schmidt-numbersAzhar, Mueed / Greiner, Andreas / Korvink, Jan G. / Kauzlarić, David et al. | 2016
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Application of classical thermodynamics to the conductivity in non-polar mediaGourdin-Bertin, S. / Chassagne, C. et al. | 2016
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Condensation on nanorods by molecular dynamicsSuh, Donguk / Yasuoka, Kenji et al. | 2016
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Double resonant absorption measurement of acetylene symmetric vibrational states probed with cavity ring down spectroscopyKarhu, J. / Nauta, J. / Vainio, M. / Metsälä, M. / Hoekstra, S. / Halonen, L. et al. | 2016
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Star-like superalkali cations featuring planar pentacoordinate carbonGuo, Jin-Chang / Tian, Wen-Juan / Wang, Ying-Jin / Zhao, Xue-Feng / Wu, Yan-Bo / Zhai, Hua-Jin / Li, Si-Dian et al. | 2016
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Diagram of states and morphologies of flexible-semiflexible copolymer chains: A Monte Carlo simulationZablotskiy, Sergey V. / Martemyanova, Julia A. / Ivanov, Viktor A. / Paul, Wolfgang et al. | 2016
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Assessing the utility of phase-space-localized basis functions: Exploiting direct product structure and a new basis function selection procedureBrown, James / Carrington, Tucker et al. | 2016
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Striped gold nanoparticles: New insights from molecular dynamics simulationsVelachi, Vasumathi / Bhandary, Debdip / Singh, Jayant K. / Cordeiro, M. Natália D. S. et al. | 2016
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Effect of functionality on unentangled star polymers at equilibrium and under shear flowXu, Xiaolei / Chen, Jizhong et al. | 2016
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Phase diagram of ammonium perchlorate: Raman spectroscopic constrains at high pressures and temperaturesDunuwille, Mihindra / Yoo, Choong-Shik et al. | 2016
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Tensor representation techniques for full configuration interaction: A Fock space approach using the canonical product formatBöhm, Karl-Heinz / Auer, Alexander A. / Espig, Mike et al. | 2016
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Non-Condon equilibrium Fermi’s golden rule electronic transition rate constants via the linearized semiclassical methodSun, Xiang / Geva, Eitan et al. | 2016
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Random sequential adsorption on imprecise latticePrivman, Vladimir / Yan, Han et al. | 2016
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AFM investigation of effect of absorbed water layer structure on growth mechanism of octadecyltrichlorosilane self-assembled monolayer on oxidized siliconLi, Shaowei / Zheng, Yanjun / Chen, Changfeng et al. | 2016