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(2020) Physical Chemistry Chemical Physics Vol. 22 (5) Royal Society of Chemistry (RSC)

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Reference TypeJournal (issue)
JournalPhysical Chemistry Chemical Physics
Year2020Volume22
Issue<   5   >
PublisherRoyal Society of Chemistry (RSC)
Mindat Ref. ID4039304Long-form Identifiermindat:1:5:4039304:3
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Full Reference(2020) Physical Chemistry Chemical Physics Vol. 22 (5) Royal Society of Chemistry (RSC)
Plain Text(2020) Physical Chemistry Chemical Physics Vol. 22 (5) Royal Society of Chemistry (RSC)
In(2020) Physical Chemistry Chemical Physics Vol. 22. Royal Society of Chemistry (RSC)

Contains

(2020) Front cover. Physical Chemistry Chemical Physics, 22 (5). 2595 doi:10.1039/d0cp90027c
(2020) Inside front cover. Physical Chemistry Chemical Physics, 22 (5). 2596 doi:10.1039/d0cp90028a
(2020) Contents list. Physical Chemistry Chemical Physics, 22 (5). 2597-2611 doi:10.1039/d0cp90029j
Asakura, Kiyotaka, Gaffney, Kelly J., Milne, Christopher, Yabashi, Makina (2020) XFELs: cutting edge X-ray light for chemical and material sciences. Physical Chemistry Chemical Physics, 22 (5). 2612-2614 doi:10.1039/c9cp90304f
Koide, Akihiro, Uemura, Yohei, Kido, Daiki, Wakisaka, Yuki, Takakusagi, Satoru, Ohtani, Bunsho, Niwa, Yasuhiro, Nozawa, Shunsuke, Ichiyanagi, Kohei, Fukaya, Ryo, Adachi, Shin-ichi, Katayama, Tetsuo, Togashi, Tadashi, Owada, Shigeki, Yabashi, Makina, Yamamoto, Yusaku, Katayama, Misaki, Hatada, Keisuke, Yokoyama, Toshihiko, Asakura, Kiyotaka (2020) Photoinduced anisotropic distortion as the electron trapping site of tungsten trioxide by ultrafast W L1-edge X-ray absorption spectroscopy with full potential multiple scattering calculations. Physical Chemistry Chemical Physics, 22 (5). 2615-2621 doi:10.1039/c9cp01332f
Suzuki, Akihiro, Kimura, Takashi, Yang, Ying, Niida, Yoshiya, Nishioka, Akiko, Tachibana, Tatsuro, Takei, Masashi, Tono, Kensuke, Yabashi, Makina, Ishikawa, Tetsuya, Oshima, Tairo, Bessho, Yoshitaka, Joti, Yasumasa, Nishino, Yoshinori (2020) Design of a liquid cell toward three-dimensional imaging of unidirectionally-aligned particles in solution using X-ray free-electron lasers. Physical Chemistry Chemical Physics, 22 (5). 2622-2628 doi:10.1039/c9cp03658j
Nanda, Kaushik D., Vidal, Marta L., Faber, Rasmus, Coriani, Sonia, Krylov, Anna I. (2020) How to stay out of trouble in RIXS calculations within equation-of-motion coupled-cluster damped response theory? Safe hitchhiking in the excitation manifold by means of core–valence separation. Physical Chemistry Chemical Physics, 22 (5). 2629-2641 doi:10.1039/c9cp03688a
Faber, Rasmus, Coriani, Sonia (2020) Core–valence-separated coupled-cluster-singles-and-doubles complex-polarization-propagator approach to X-ray spectroscopies. Physical Chemistry Chemical Physics, 22 (5). 2642-2647 doi:10.1039/c9cp03696b
You, Daehyun, Fukuzawa, Hironobu, Luo, Yu, Saito, Shu, Berholts, Marta, Gaumnitz, Thomas, Huttula, Marko, Johnsson, Per, Kishimoto, Naoki, Myllynen, Hanna, Nemer, Ahmad, Niozu, Akinobu, Patanen, Minna, Pelimanni, Eetu, Takanashi, Tsukasa, Wada, Shin-ichi, Yokono, Naomichi, Owada, Shigeki, Tono, Kensuke, Yabashi, Makina, Nagaya, Kiyonobu, Kukk, Edwin, Ueda, Kiyoshi (2020) Multi-particle momentum correlations extracted using covariance methods on multiple-ionization of diiodomethane molecules by soft-X-ray free-electron laser pulses. Physical Chemistry Chemical Physics, 22 (5). 2648-2659 doi:10.1039/c9cp03638e
Britz, Alexander, Abraham, Baxter, Biasin, Elisa, van Driel, Tim Brandt, Gallo, Alessandro, Garcia-Esparza, Angel T., Glownia, James, Loukianov, Anton, Nelson, Silke, Reinhard, Marco, Sokaras, Dimosthenis, Alonso-Mori, Roberto (2020) Resolving structures of transition metal complex reaction intermediates with femtosecond EXAFS. Physical Chemistry Chemical Physics, 22 (5). 2660-2666 doi:10.1039/c9cp03483h
Northey, T., Norell, J., Fouda, A. E. A., Besley, N. A., Odelius, M., Penfold, T. J. (2020) Ultrafast nonadiabatic dynamics probed by nitrogen K-edge absorption spectroscopy. Physical Chemistry Chemical Physics, 22 (5). 2667-2676 doi:10.1039/c9cp03019k
Wang, Hsin-Yi, Schreck, Simon, Weston, Matthew, Liu, Chang, Ogasawara, Hirohito, LaRue, Jerry, Perakis, Fivos, Dell’Angela, Martina, Capotondi, Flavio, Giannessi, Luca, Pedersoli, Emanuele, Naumenko, Denys, Nikolov, Ivaylo, Raimondi, Lorenzo, Spezzani, Carlo, Beye, Martin, Cavalca, Filippo, Liu, Boyang, Gladh, Jörgen, Koroidov, Sergey, Miedema, Piter S., Costantini, Roberto, Pettersson, Lars G. M., Nilsson, Anders (2020) Time-resolved observation of transient precursor state of CO on Ru(0001) using carbon K-edge spectroscopy. Physical Chemistry Chemical Physics, 22 (5). 2677-2684 doi:10.1039/c9cp03677f
Ismail, Ahmed S. M., Uemura, Yohei, Park, Sang Han, Kwon, Soonnam, Kim, Minseok, Elnaggar, Hebatalla, Frati, Federica, Niwa, Yasuhiro, Wadati, Hiroki, Hirata, Yasuyuki, Zhang, Yujun, Yamagami, Kohei, Yamamoto, Susumu, Matsuda, Iwao, Halisdemir, Ufuk, Koster, Gertjan, Weckhuysen, Bert M., de Groot, Frank M. F. (2020) Direct observation of the electronic states of photoexcited hematite with ultrafast 2p3d X-ray absorption spectroscopy and resonant inelastic X-ray scattering. Physical Chemistry Chemical Physics, 22 (5). 2685-2692 doi:10.1039/c9cp03374b
Vidal, Marta L., Krylov, Anna I., Coriani, Sonia (2020) Dyson orbitals within the fc-CVS-EOM-CCSD framework: theory and application to X-ray photoelectron spectroscopy of ground and excited states. Physical Chemistry Chemical Physics, 22 (5). 2693-2703 doi:10.1039/c9cp03695d
Driver, Taran, Li, Siqi, Champenois, Elio G., Duris, Joseph, Ratner, Daniel, Lane, Thomas J., Rosenberger, Philipp, Al-Haddad, Andre, Averbukh, Vitali, Barnard, Toby, Berrah, Nora, Bostedt, Christoph, Bucksbaum, Philip H., Coffee, Ryan, DiMauro, Louis F., Fang, Li, Garratt, Douglas, Gatton, Averell, Guo, Zhaoheng, Hartmann, Gregor, Haxton, Daniel, Helml, Wolfram, Huang, Zhirong, LaForge, Aaron, Kamalov, Andrei, Kling, Matthias F., Knurr, Jonas, Lin, Ming-Fu, Lutman, Alberto A., MacArthur, James P., Marangos, Jon P., Nantel, Megan, Natan, Adi, Obaid, Razib, O'Neal, Jordan T., Shivaram, Niranjan H., Schori, Aviad, Walter, Peter, Li Wang, Anna, Wolf, Thomas J. A., Marinelli, Agostino, Cryan, James P. (2020) Attosecond transient absorption spooktroscopy: a ghost imaging approach to ultrafast absorption spectroscopy. Physical Chemistry Chemical Physics, 22 (5). 2704-2712 doi:10.1039/c9cp03951a
Ahmed, Musahid, Kostko, Oleg (2020) From atoms to aerosols: probing clusters and nanoparticles with synchrotron based mass spectrometry and X-ray spectroscopy. Physical Chemistry Chemical Physics, 22 (5). 2713-2737 doi:10.1039/c9cp05802h
Chi, Hao, Curnan, Matthew T., Li, Meng, Andolina, Christopher M., Saidi, Wissam A., Veser, Götz, Yang, Judith C. (2020) In situ environmental TEM observation of two-stage shrinking of Cu2O islands on Cu(100) during methanol reduction. Physical Chemistry Chemical Physics, 22 (5). 2738-2742 doi:10.1039/c9cp05831a
Ren, Zhijun, Zhou, Guangdong, Wei, Shiqiang (2020) Multilevel resistive switching memory behaviors arising from ion diffusion and photoelectron transfer in α-Fe2O3 nano-island arrays. Physical Chemistry Chemical Physics, 22 (5). 2743-2747 doi:10.1039/c9cp06392g
Derevyanko, Nadezhda A., Ishchenko, Alexander A., Kulinich, Andrii V. (2020) Deeply coloured and highly fluorescent dipolar merocyanines based on tricyanofuran. Physical Chemistry Chemical Physics, 22 (5). 2748-2762 doi:10.1039/c9cp05827c
Niemann, Thomas, Zaitsau, Dzmitry H., Strate, Anne, Stange, Peter, Ludwig, Ralf (2020) Controlling “like–likes–like” charge attraction in hydroxy-functionalized ionic liquids by polarizability of the cations, interaction strength of the anions and varying alkyl chain length. Physical Chemistry Chemical Physics, 22 (5). 2763-2774 doi:10.1039/c9cp06481h
Saini, Himanshu, Jyothirmai, M. V., Waghmare, Umesh V., Thapa, Ranjit (2020) Role of van der Waals interaction in enhancing the photon absorption capability of the MoS2/2D heterostructure. Physical Chemistry Chemical Physics, 22 (5). 2775-2782 doi:10.1039/c9cp05782j
Brezesinski, G., Rudert, R., Vollhardt, D. (2020) Lattice and thermodynamic characteristics of N-stearoyl-allo-threonine monolayers. Physical Chemistry Chemical Physics, 22 (5). 2783-2791 doi:10.1039/c9cp06304h
Avila, Gustavo, Papp, Dóra, Czakó, Gábor, Mátyus, Edit (2020) Exact quantum dynamics background of dispersion interactions: case study for CH4·Ar in full (12) dimensions. Physical Chemistry Chemical Physics, 22 (5). 2792-2802 doi:10.1039/c9cp04426d
Yañez-Aulestia, Ana, Wang, Qiang, Pfeiffer, Heriberto (2020) Enhancing CO2 chemisorption on lithium cuprate (Li2CuO2) at moderate temperatures and different pressures by alkaline nitrate addition. Physical Chemistry Chemical Physics, 22 (5). 2803-2813 doi:10.1039/c9cp05512f
Adachi, Shunsuke, Suzuki, Toshinori (2020) Methyl substitution effects on the non-adiabatic dynamics of benzene: lifting three-state quasi-degeneracy at conical intersections. Physical Chemistry Chemical Physics, 22 (5). 2814-2818 doi:10.1039/c9cp06164a
Yang, Xiongfeng, Liu, Min, Liu, Jiandang, Xia, Yuanhua, Ji, Weiwei, Li, Zhiang, Chen, Jifang, Liu, Liu, Hao, Luyuan, Dong, Bingbing, Agathopoulos, Simeon, Xu, Xin (2020) Mechanism of upconversion luminescence enhancement in Yb3+/Er3+ co-doped Y2O3 through Li+ incorporation. Physical Chemistry Chemical Physics, 22 (5). 2819-2826 doi:10.1039/c9cp06137a
Ren, Chunxing, Liu, Han, Li, Xiaoxia, Guo, Li (2020) Decomposition mechanism scenarios of CL-20 co-crystals revealed by ReaxFF molecular dynamics: similarities and differences. Physical Chemistry Chemical Physics, 22 (5). 2827-2840 doi:10.1039/c9cp06102a
Wu, Hao, Hu, Chang-Le, Wang, Jin, Sun, Yu R., Tan, Yan, Liu, An-Wen, Hu, Shui-Ming (2020) A well-isolated vibrational state of CO2 verified by near-infrared saturated spectroscopy with kHz accuracy. Physical Chemistry Chemical Physics, 22 (5). 2841-2848 doi:10.1039/c9cp05121j
Zhao, Chaoyue, Qiao, Xianliang, Yi, Zenghuimin, Guan, Qingxin, Li, Wei (2020) Active centre and reactivity descriptor of a green single component imidazole catalyst for acetylene hydrochlorination. Physical Chemistry Chemical Physics, 22 (5). 2849-2857 doi:10.1039/c9cp06005g
Li, Peizhi, Yang, Zhipeng, Zhang, Zhong, Pu, Liang, King, R. Bruce (2020) Understanding the singlet–triplet energy splittings in transition metal-capped carbon chains. Physical Chemistry Chemical Physics, 22 (5). 2858-2869 doi:10.1039/c9cp06591a
Zimmermann, C., Gottschalk, H. C., Suhm, M. A. (2020) Three-dimensional docking of alcohols to ketones: an experimental benchmark based on acetophenone solvation energy balances. Physical Chemistry Chemical Physics, 22 (5). 2870-2877 doi:10.1039/c9cp06128b
Ju, Zhaoyang, Xiao, Weihua, Yao, Xiaoqian, Tan, Xin, Simmons, Blake A., Sale, Kenneth L., Sun, Ning (2020) Theoretical study on the microscopic mechanism of lignin solubilization in Keggin-type polyoxometalate ionic liquids. Physical Chemistry Chemical Physics, 22 (5). 2878-2886 doi:10.1039/c9cp05339e
Fisher, Trevor R., Zhou, Guobing, Shi, Yijun, Huang, Liangliang (2020) How does hydrogen bond network analysis reveal the golden ratio of water–glycerol mixtures?. Physical Chemistry Chemical Physics, 22 (5). 2887-2907 doi:10.1039/c9cp06246g
Suzuki, Yasumitsu, Watanabe, Kazuyuki (2020) Excitons in two-dimensional atomic layer materials from time-dependent density functional theory: mono-layer and bi-layer hexagonal boron nitride and transition-metal dichalcogenides. Physical Chemistry Chemical Physics, 22 (5). 2908-2916 doi:10.1039/c9cp06034k
Karimi, Mohammad Bagher, Mohammadi, Fereidoon, Hooshyari, Khadijeh (2020) Non-humidified fuel cells using a deep eutectic solvent (DES) as the electrolyte within a polymer electrolyte membrane (PEM): the effect of water and counterions. Physical Chemistry Chemical Physics, 22 (5). 2917-2929 doi:10.1039/c9cp06207f
Shi, Lu, Yang, Jiaqiang, Shen, Gurong, Zhao, Yunkun, Chen, Rong, Shen, Meiqing, Wen, Yanwei, Shan, Bin (2020) The influence of adjacent Al atoms on the hydrothermal stability of H-SSZ-13: a first-principles study. Physical Chemistry Chemical Physics, 22 (5). 2930-2937 doi:10.1039/c9cp05141d
Wang, Ke, Ning, Shangbo, Guo, Yue, Duan, Mojie, Yang, Minghui (2020) The regulation mechanism of phosphorylation and mutations in intrinsically disordered protein 4E-BP2. Physical Chemistry Chemical Physics, 22 (5). 2938-2948 doi:10.1039/c9cp05888e
Baskurt, Mehmet, Kang, Jun, Sahin, Hasan (2020) Octahedrally coordinated single layered CaF2: robust insulating behaviour. Physical Chemistry Chemical Physics, 22 (5). 2949-2954 doi:10.1039/c9cp06015d
Kim, Eun Mi, Javaid, Saqib, Park, Jong Hyeok, Lee, Geunsik (2020) Edge functionalized graphene nanoribbons with tunable band edges for carrier transport interlayers in organic–inorganic perovskite solar cells. Physical Chemistry Chemical Physics, 22 (5). 2955-2962 doi:10.1039/c9cp06430c
Maire du Poset, Aline, Zitolo, Andrea, Cousin, Fabrice, Assifaoui, Ali, Lerbret, Adrien (2020) Evidence for an egg-box-like structure in iron(ii)–polygalacturonate hydrogels: a combined EXAFS and molecular dynamics simulation study. Physical Chemistry Chemical Physics, 22 (5). 2963-2977 doi:10.1039/c9cp04065j
Shi, Le, Ying, Zhixuan, Xu, Ao, Cheng, Yonghong (2020) Anomalous proton conduction behavior across a nanoporous two-dimensional conjugated aromatic polymer membrane. Physical Chemistry Chemical Physics, 22 (5). 2978-2985 doi:10.1039/c9cp06372b
Khopkar, Vijay, Sahoo, Balaram (2020) Low temperature dielectric properties and NTCR behavior of the BaFe0.5Nb0.5O3 double perovskite ceramic. Physical Chemistry Chemical Physics, 22 (5). 2986-2998 doi:10.1039/c9cp05707b
Cheng, Ruodi, Loire, Estelle, Martens, Jonathan, Fridgen, Travis D. (2020) An IRMPD spectroscopic and computational study of protonated guanine-containing mismatched base pairs in the gas phase. Physical Chemistry Chemical Physics, 22 (5). 2999-3007 doi:10.1039/c9cp06393e
Vieira Pinto, Sandra Mónica, Tasinato, Nicola, Barone, Vincenzo, Amadei, Andrea, Zanetti-Polzi, Laura, Daidone, Isabella (2020) Modeling amino-acid side chain infrared spectra: the case of carboxylic residues. Physical Chemistry Chemical Physics, 22 (5). 3008-3016 doi:10.1039/c9cp04774c
Valero, Rosendo, Morales-García, Ángel, Illas, Francesc (2020) Investigating the character of excited states in TiO2 nanoparticles from topological descriptors: implications for photocatalysis. Physical Chemistry Chemical Physics, 22 (5). 3017-3029 doi:10.1039/c9cp05526f
Shen, Kun, Wang, Yixuan, Zhang, Jun, Zong, Yi, Li, Gengwei, Zhao, Changchun, Chen, Hao (2020) Revealing the effect of grain boundary segregation on Li ion transport in polycrystalline anti-perovskite Li3ClO: a phase field study. Physical Chemistry Chemical Physics, 22 (5). 3030-3036 doi:10.1039/c9cp06055c
Si, Yuan, Wu, Hong-Yu, Lian, Ji-Chun, Huang, Wei-Qing, Hu, Wang-Yu, Huang, Gui-Fang (2020) A design rule for two-dimensional van der Waals heterostructures with unconventional band alignments. Physical Chemistry Chemical Physics, 22 (5). 3037-3047 doi:10.1039/c9cp06465f
Castellanos, Maria A., Dodin, Amro, Willard, Adam P. (2020) On the design of molecular excitonic circuits for quantum computing: the universal quantum gates. Physical Chemistry Chemical Physics, 22 (5). 3048-3057 doi:10.1039/c9cp05625d
Zhou, Tian, Li, Zhuhong, Cheng, Yajuan, Ni, Yuxiang, Volz, Sebastian, Donadio, Davide, Xiong, Shiyun, Zhang, Wenqing, Zhang, Xiaohong (2020) Thermal transport in amorphous small organic materials: a mechanistic study. Physical Chemistry Chemical Physics, 22 (5). 3058-3065 doi:10.1039/c9cp05938e
Wang, Chao, Liu, Yunxian, Chen, Xin, Lv, Pin, Sun, Hairui, Liu, Xiaobing (2020) Pressure-induced unexpected −2 oxidation states of bromine and superconductivity in magnesium bromide. Physical Chemistry Chemical Physics, 22 (5). 3066-3072 doi:10.1039/c9cp05627k
Khatymov, Rustem V., Shchukin, Pavel V., Muftakhov, Mars V., Yakushchenko, Igor K., Yarmolenko, Ol'ga V., Pankratyev, Evgeniy Yu. (2020) A unified statistical RRKM approach to the fragmentation and autoneutralization of metastable molecular negative ions of hexaazatrinaphthylenes. Physical Chemistry Chemical Physics, 22 (5). 3073-3088 doi:10.1039/c9cp05397b
Kitayama, Hiroki, Ekayev, Mukam Charyyarovich, Ohba, Tomonori (2020) Piezoresistive and chemiresistive gas sensing by metal-free graphene layers. Physical Chemistry Chemical Physics, 22 (5). 3089-3096 doi:10.1039/c9cp05586j
Hagara, Jakub, Mrkyvkova, Nada, Nádaždy, Peter, Hodas, Martin, Bodík, Michal, Jergel, Matej, Majková, Eva, Tokár, Kamil, Hutár, Peter, Sojková, Michaela, Chumakov, Andrei, Konovalov, Oleg, Pandit, Pallavi, Roth, Stephan, Hinderhofer, Alexander, Hulman, Martin, Siffalovic, Peter, Schreiber, Frank (2020) Reorientation of π-conjugated molecules on few-layer MoS2 films. Physical Chemistry Chemical Physics, 22 (5). 3097-3104 doi:10.1039/c9cp05728e
Wu, Chao, Guo, Daoyou, Li, Peigang, Wang, Shunli, Liu, Aiping, Wu, Fengmin (2020) A study on the effects of mixed organic cations on the structure and properties in lead halide perovskites. Physical Chemistry Chemical Physics, 22 (5). 3105-3111 doi:10.1039/c9cp06182g
Komeily-Nia, Zahra, Chen, Jing-Yu, Nasri-Nasrabadi, Bijan, Lei, Wei-Wei, Yuan, Bing, Zhang, Jin, Qu, Liang-Ti, Gupta, Akhil, Li, Jing-Liang (2020) The key structural features governing the free radicals and catalytic activity of graphite/graphene oxide. Physical Chemistry Chemical Physics, 22 (5). 3112-3121 doi:10.1039/c9cp05488j
Pulikkotil, J. J. (2020) A spin–orbit coupling-induced two-dimensional electron gas in BiAlO3/SrTiO3 heterostructures. Physical Chemistry Chemical Physics, 22 (5). 3122-3127 doi:10.1039/c9cp05737d
Sun, Jiaxiang, Zhong, Xin, Cui, Wenwen, Shi, Jingming, Hao, Jian, Xu, Meiling, Li, Yinwei (2020) Correction: The intrinsic magnetism, quantum anomalous Hall effect and Curie temperature in 2D transition metal trihalides. Physical Chemistry Chemical Physics, 22 (5). 3128 doi:10.1039/d0cp90018d
(2020) Inside back cover. Physical Chemistry Chemical Physics, 22 (5). 3129 doi:10.1039/d0cp90030c
(2020) Back cover. Physical Chemistry Chemical Physics, 22 (5). 3130 doi:10.1039/d0cp90031a

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