On the intramolecular vibrational energy redistribution dynamics of aromatic complexes: A comparative study on C6H6–C6H5Cl, C6H6–C6H3Cl3, C6H6–C6Cl6 and C6H6–C6H5F, C6H6–C6H3F3, C6H6–C6F6 (English)
- New search for: Deb, Basudha
- New search for: Mahanta, Himashree
- New search for: Baruah, Netra Prava
- New search for: Khardewsaw, Maitjingshai
- New search for: Paul, Amit Kumar
- New search for: Deb, Basudha
- New search for: Mahanta, Himashree
- New search for: Baruah, Netra Prava
- New search for: Khardewsaw, Maitjingshai
- New search for: Paul, Amit Kumar
In:
The Journal of Chemical Physics
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160
, 2
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13
;
2024
- Article (Journal) / Electronic Resource
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Title:On the intramolecular vibrational energy redistribution dynamics of aromatic complexes: A comparative study on C6H6–C6H5Cl, C6H6–C6H3Cl3, C6H6–C6Cl6 and C6H6–C6H5F, C6H6–C6H3F3, C6H6–C6F6
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Additional title:Deb et al.
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Contributors:Deb, Basudha ( author ) / Mahanta, Himashree ( author ) / Baruah, Netra Prava ( author ) / Khardewsaw, Maitjingshai ( author ) / Paul, Amit Kumar ( author )
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Published in:The Journal of Chemical Physics ; 160, 2 ; 13
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Publisher:
- New search for: AIP Publishing LLC
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Publication date:2024-01-14
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Size:13 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 160, Issue 2
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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Lyotropic liquid crystal phases of monoolein in protic ionic liquidsPaporakis, Stefan / Brown, Stuart J. / Darmanin, Connie / Seibt, Susanne / Adams, Patrick / Hassett, Michael / Martin, Andrew V. / Greaves, Tamar L. et al. | 2024
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Developing correlation-consistent numeric atom-centered orbital basis sets for krypton: Applications in RPA-based correlated calculationsYang, Sixian / Zhang, Igor Ying / Ren, Xinguo et al. | 2024
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Efficient characterization of double-cross-linked networks in hydrogels using data-inspired coarse-grained molecular dynamics modelZong, Ting / Liu, Xia / Zhang, Xingyu / Yang, Qingsheng et al. | 2024
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On the intramolecular vibrational energy redistribution dynamics of aromatic complexes: A comparative study on C6H6–C6H5Cl, C6H6–C6H3Cl3, C6H6–C6Cl6 and C6H6–C6H5F, C6H6–C6H3F3, C6H6–C6F6Deb, Basudha / Mahanta, Himashree / Baruah, Netra Prava / Khardewsaw, Maitjingshai / Paul, Amit Kumar et al. | 2024
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Multi-phase retrieval of methane hydrate in natural sediments by cryogenic x-ray computed tomographyTakeya, Satoshi / Hachikubo, Akihiro / Sakagami, Hirotoshi / Minami, Hirotsugu / Yamashita, Satoshi / Hirano, Keiichi / Hyodo, Kazuyuki / Yoneyama, Akio et al. | 2024
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Increase in the effective viscosity of polyethylene under extreme nanoconfinementRen, Tian / Hinton, Zachary R. / Huang, Renjing / Epps, Thomas H. / Korley, LaShanda / Gorte, Raymond J. / Lee, Daeyeon et al. | 2024
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Degeneration of kernel regression with Matern kernels into low-order polynomial regression in high dimensionManzhos, Sergei / Ihara, Manabu et al. | 2024
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Conformational preference of 2-(4-methoxyphenyl)ethanol studied by supersonic jet spectroscopy: Intramolecular OH/π interactionNagasawa, Hironari / Ogawa, Sakuya / Kashihara, Wataru / Isozaki, Tasuku / Hirata, Keisuke / Ishiuchi, Shun-ichi / Fujii, Masaaki / Suzuki, Tadashi et al. | 2024
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Electronic spectra of jet-cooled 1,4-bis(phenylethynyl)benzene: Strength in π-electron conjugation and two large-amplitude torsional motionsSuzuki, Ryoko / Chiba, Kohei / Tanaka, Sei’ichi / Okuyama, Katsuhiko et al. | 2024
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Growth kinetics and morphology characterization of binary polymeric fluid under random photo-illuminationSingh, Ashish Kumar / Chauhan, Avinash / Singh, Awaneesh et al. | 2024
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Kinetic pathway and micromechanics of fusion/fission for polyelectrolyte vesiclesLiu, Luofu / Duan, Chao / Wang, Rui et al. | 2024
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Electromagnetic enhancement spectra of one-dimensional plasmonic hotspots along silver nanowire dimer derived via surface-enhanced fluorescenceItoh, Tamitake / Yamamoto, Yuko S. et al. | 2024
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Diagrammatic theory of magnetic and quadrupolar contributions to sum-frequency generation in composite systemsNoblet, Thomas / Busson, Bertrand et al. | 2024
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Comprehensive quantum calculation of the first dielectric virial coefficient of waterGarberoglio, Giovanni / Lissoni, Chiara / Spagnoli, Luca / Harvey, Allan H. et al. | 2024
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Exchange energies with forces in density-functional theoryTancogne-Dejean, Nicolas / Penz, Markus / Laestadius, Andre / Csirik, Mihály A. / Ruggenthaler, Michael / Rubio, Angel et al. | 2024
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Role of a cyclopentadienyl ligand in a heteroleptic alkoxide precursor in atomic layer depositionYoon, Hwi / Lee, Yujin / Lee, Ga Yeon / Seo, Seunggi / Park, Bo Keun / Chung, Taek-Mo / Oh, Il-Kwon / Kim, Hyungjun et al. | 2024
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On the origin of time-aging-time superpositionRichert, Ranko et al. | 2024
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In-based coordination polymer-derived carbon nanoribbons with abundant CoP nanoparticles in carbon nanotubes for water oxidationWang, Xiaofang / Guo, Yuanyuan / Shen, Yanqiong / Qian, Jinjie et al. | 2024
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Mechanisms of ion transport in lithium salt-doped zwitterionic polymer-supported ionic liquid electrolytesTadesse, Meron Y. / Zhang, Zidan / Marioni, Nico / Zofchak, Everett S. / Duncan, Tyler J. / Ganesan, Venkat et al. | 2024
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Benchmarking the accuracy of the separable resolution of the identity approach for correlated methods in the numeric atom-centered orbitals frameworkDelesma, Francisco A. / Leucke, Moritz / Golze, Dorothea / Rinke, Patrick et al. | 2024
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Massively parallel implementation of gradients within the random phase approximation: Application to the polymorphs of benzeneStein, Frederick / Hutter, Jürg et al. | 2024
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Time propagation of electronic wavefunctions using nonorthogonal determinant expansionsDong, Xinju / Thompson, Lee M. et al. | 2024
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Nuclear quantum effects in the acetylene:ammonia plastic co-crystalThakur, Atul C. / Remsing, Richard C. et al. | 2024
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On De Gennes narrowing of fluids confined at the molecular scale in nanoporous materialsKellouai, Wanda / Barrat, Jean-Louis / Judeinstein, Patrick / Plazanet, Marie / Coasne, Benoit et al. | 2024
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Necessary and sufficient symmetries in Event-Chain Monte Carlo with generalized flows and application to hard dimersGuyon, Tristan / Guillin, Arnaud / Michel, Manon et al. | 2024
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Highly efficient creation and detection of deeply bound molecules via invariant-based inverse engineering with feasible modified drivingsZhang, Jiahui et al. | 2024
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The curious case of CO2 dissociation on Cu(110)Singh, Saurabh Kumar / Shirhatti, Pranav R. et al. | 2024
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Quantifying the energy landscape in weakly and strongly disordered frictional mediaLi, Ming-Gen / Hu, Meng / Fan, Li-Ming / Bao, Jing-Dong / Li, Peng-Cheng et al. | 2024
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External field-driven property localization in liquids of responsive macromoleculesMoncho-Jordá, Arturo / Groh, Sebastien / Dzubiella, Joachim et al. | 2024
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Energetic processing of thioacetamide in cryogenic matricesGóbi, Sándor / Keresztes, Barbara / Schneiker, Anita / Ragupathy, Gopi / Tarczay, György et al. | 2024
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Time-dependent coupled cluster with orthogonal adaptive basis functions: General formalism and application to the vibrational problemHøjlund, Mads Greisen / Zoccante, Alberto / Christiansen, Ove et al. | 2024
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Stability and thinning of liquid jets in the presence of soluble surfactantsLi, Jiayu / Manikantan, Harishankar et al. | 2024
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Linear and angular momentum conservation in surface hopping methodsWu, Yanze / Rawlinson, Jonathan / Littlejohn, Robert G. / Subotnik, Joseph E. et al. | 2024
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A recursive cell multipole method for atomistic electrodynamics modelsBronson, Mark J. / Jensen, Lasse et al. | 2024
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Data-driven dynamical coarse-graining for condensed matter systemsdel Razo, Mauricio J. / Crommelin, Daan / Bolhuis, Peter G. et al. | 2024
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Controlling the nonadiabatic dynamics of the charge-transfer process with chirped pulses: Insights from a double-pump time-resolved fluorescence spectroscopy schemeSoh, Jia Hao / Jansen, Thomas L. C. / Palacino-González, Elisa et al. | 2024
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Bicontinuous microemulsion in binary blends of complementary diblock copolymersWillis, J. D. / Matsen, M. W. et al. | 2024
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Dissociation following the Auger decay of xenon difluoride moleculesHikosaka, Yasumasa et al. | 2024
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Efficient single-run implementation of generalized Einstein relation to compute transport coefficients: A binary-based time samplingMoustafa, Sabry G. / Schultz, Andrew J. / Douglas, Jack F. et al. | 2024
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Assessing r2SCAN meta-GGA functional for structural parameters, cohesive energy, mechanical modulus, and thermophysical properties of 3d, 4d, and 5d transition metalsLiu, Haoliang / Bai, Xue / Ning, Jinliang / Hou, Yuxuan / Song, Zifeng / Ramasamy, Akilan / Zhang, Ruiqi / Li, Yefei / Sun, Jianwei / Xiao, Bing et al. | 2024
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Simulations of disordered matter in 3D with the morphological autoregressive protocol (MAP) and convolutional neural networksMadanchi, Ata / Kilgour, Michael / Zysk, Frederik / Kühne, Thomas D. / Simine, Lena et al. | 2024
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Ideal conductor/dielectric model (ICDM): A generalized technique to correct for finite-size effects in molecular simulations of hindered ion transportShoemaker, Brian A. / Haji-Akbari, Amir et al. | 2024
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Spectroscopic detection of the gallium methylene (GaCH2 and GaCD2) free radical in the gas phase by laser-induced fluorescence and emission spectroscopySmith, Tony C. / Tarroni, Riccardo / Clouthier, Dennis J. et al. | 2024
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Distilling coarse-grained representations of molecular electronic structure with continuously gated message passingMaier, J. Charlie / Wang, Chun-I / Jackson, Nicholas E. et al. | 2024
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Nuclear induction line shape: Non-Markovian diffusion with boundariesNiknam, Mohamad / Bouchard, Louis-S. et al. | 2024
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Infrared spectroscopy of the α-hydroxyethyl radical isolated in cryogenic solid mediaZasimov, Pavel V. / Volosatova, Anastasia D. / Góbi, Sándor / Keresztes, Barbara / Tyurin, Daniil A. / Feldman, Vladimir I. / Tarczay, György et al. | 2024
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Effect of film morphology on circular dichroism of low-dimensional chiral hybrid perovskitesMakhija, Urmila / Rajput, Parikshit Kumar / Parthiban, Pavithra / Nag, Angshuman et al. | 2024
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Dense random packing of disks with a power-law size distribution in thermodynamic limitCherny, Alexander Yu. / Anitas, Eugen M. / Vladimirov, Artem A. / Osipov, Vladimir A. et al. | 2024
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Bottom-to-top modeling of epoxy resins: From atomic models to mesoscale fracture mechanismsKonrad, Julian / Zahn, Dirk et al. | 2024
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Reshaping and induction of optical activity in gold@silver nanocuboids by chiral glutathione moleculesEngel, Yael Levitan / Feferman, Daniel / Ghalawat, Monika / Santiago, Eva Yazmin / Avalos-Ovando, Oscar / Govorov, Alexander O. / Markovich, Gil et al. | 2024
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Vibronic coupling of Rhodamine 6G molecules studied by doubly resonant sum frequency generation spectroscopy with narrowband infrared and broadband visibleZeng, Wei-Wang / Luo, Ting / Xu, Peng / Zhou, Chuanyao / Yang, Xueming / Ren, Zefeng / 曾维旺 / 罗婷 / 徐鹏 / 周传耀 et al. | 2024