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Raman Spectroscopic and Theoretical Study of Scandium Fluoride and Oxyfluoride Anions in Molten FLiNaK 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2020, 卷号: 124, 期号: 30, 页码: 6671-6678
Authors:  Wang, CY;  Chen, XT;  Wei, R;  Gong, Y
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DENSITY-FUNCTIONAL THEORY  HIGH-TEMPERATURE NMR  BIS(TRIFLUOROMETHANESULFONYL) IMIDE ANION  IONIC LIQUID  VIBRATIONAL-SPECTRA  RARE-EARTH  MOLECULAR-DYNAMICS  LOCAL-STRUCTURE  BINARY MELTS  BASIS-SET  
Probing the Hydrogen Bonding in Microsolvated Clusters of Au-1,2(-)(Solv)(n) (Solv = C2H5OH, n-C3H7OH; n=1-3 for Au-; n=1 for Au-2(-)) 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2020, 卷号: 124, 期号: 27, 页码: 5590-5598
Authors:  Wang, YT;  Han, CC;  Fei, ZJ;  Dong, CW;  Liu, HT
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QUADRATIC CONFIGURATION-INTERACTION  GENERALIZED GRADIENT APPROXIMATION  VAPOR-PHASE HYDROCHLORINATION  CATALYTIC-ACTIVITY  CO OXIDATION  PHOTOELECTRON-SPECTROSCOPY  DENSITY FUNCTIONALS  AEROBIC OXIDATION  CARBON-DIOXIDE  BASIS-SETS  
Role of local coordination in bimetallic sites for oxygen reduction: A theoretical analysis 期刊论文
JOURNAL OF ENERGY CHEMISTRY, 2020, 卷号: 44, 页码: 131-137
Authors:  Yang, YQ;  Zhang, H;  Liang, ZF;  Yin, YR;  Mei, BB;  Song, F;  Sun, FF;  Gu, SQ;  Jiang, Z;  Wu, YE;  Zhu, ZY
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TOTAL-ENERGY CALCULATIONS  ACTIVE-SITES  ELECTROCATALYSTS  CATALYSTS  DESIGN  IDENTIFICATION  PERFORMANCE  CARBON  CON4  
Optimizing Electron Densities of Ni-N-C Complexes by Hybrid Coordination for Efficient Electrocatalytic CO2 Reduction 期刊论文
CHEMSUSCHEM, 2020, 卷号: 13, 期号: 5, 页码: 929-937
Authors:  Wang, ZL;  Choi, J;  Xu, MQ;  Hao, XF;  Zhang, H;  Jiang, Z;  Zuo, M;  Kim, J;  Zhou, W;  Meng, XG;  Yu, Q;  Sun, ZH;  Wei, SQ;  Ye, JH;  Wallace, GG;  Officer, DL;  Yamauchi, Y
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ORGANIC FRAMEWORKS  ELECTROREDUCTION  SITES  CATALYSTS  IRON  
End-On Cyanogen Complexes of Iridium, Palladium, and Platinum 期刊论文
INORGANIC CHEMISTRY, 2020, 卷号: 59, 期号: 9, 页码: 6489-6495
Authors:  Chen, XT;  Xiong, ZX;  Andrews, L;  Gong, Y
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MATRIX INFRARED-SPECTRA  ANION PHOTOELECTRON-SPECTROSCOPY  DENSITY-FUNCTIONAL CALCULATIONS  LASER-ABLATED PLATINUM  THEORETICAL INVESTIGATIONS  COORDINATION CHEMISTRY  HYDROGEN-CYANIDE  BASIS-SETS  ATOMS  NICKEL  
Investigation of the linear and mode-coupled flow harmonics in Au plus Au collisions at root s(NN)=200 GeV 期刊论文
PHYSICS LETTERS B, 2020, 卷号: 809, 页码: -
Authors:  Adam, J;  Adamczyk, L;  Adams, JR;  Adkins, JK;  Agakishiev, G;  Aggarwal, MM;  Ahammed, Z;  Alekseev, I;  Anderson, DM;  Aparin, A;  Aschenauer, EC;  Ashraf, MU;  Atetalla, FG;  Attri, A;  Averichev, GS;  Bairathi, V;  Barish, K;  Behera, A;  Bellwied, R;  Bhasin, A;  Bielcik, J;  Bielcikova, J;  Bland, LC;  Bordyuzhin, IG;  Brandenburg, JD;  Brandin, AV;  Butterworth, J;  Caines, H;  Sanchez, MCD;  Cebra, D;  Chakaberia, I;  Chaloupka, P;  Chan, BK;  Chang, FH;  Chang, Z;  Chankova-Bunzarova, N;  Chatterjee, A;  Chen, D;  Chen, JH;  Chen, X;  Chen, Z;  Cheng, J;  Cherney, M;  Chevalier, M;  Choudhury, S;  Christie, W;  Chu, X;  Crawford, HJ;  Csanad, M;  Daugherity, M;  Dedovich, TG;  Deppner, IM;  Derevschikov, AA;  Didenko, L;  Dong, X;  Drachenberg, JL;  Dunlop, JC;  Edmonds, T;  Elsey, N;  Engelage, J;  Eppley, G;  Esumi, S;  Evdokimov, O;  Ewigleben, A;  Eyser, O;  Fatemi, R;  Fazio, S;  Federic, P;  Fedorisin, J;  Feng, CJ;  Feng, Y;  Filip, P;  Finch, E;  Fisyak, Y;  Francisco, A;  Fulek, L;  Gagliardi, CA;  Galatyuk, T;  Geurts, F;  Gibson, A;  Gopal, K;  Grosnick, D;  Guryn, W;  Hamad, AI;  Hamed, A;  Harabasz, S;  Harris, JW;  He, S;  He, W;  He, XH;  Heppelmann, S;  Herrmann, N;  Hoffman, E;  Holub, L;  Hong, Y;  Horvat, S;  Hu, Y;  Huang, HZ;  Huang, SL;  Huang, T;  Huang, X;  Humanic, TJ;  Huo, P;  Igo, G;  Isenhower, D;  Jacobs, WW;  Jena, C;  Jentsch, A;  Ji, Y;  Jia, J;  Jiang, K;  Jowzaee, S;  Ju, X;  Judd, EG;  Kabana, S;  Kabir, ML;  Kagamaster, S;  Kalinkin, D;  Kang, K;  Kapukchyan, D;  Kauder, K;  Ke, HW;  Keane, D;  Kechechyan, A;  Kelsey, M;  Khyzhniak, YV;  Kikola, DP;  Kim, C;  Kimelman, B;  Kincses, D;  Kinghorn, TA;  Kisel, I;  Kiselev, A;  Kocan, M;  Kochenda, L;  Kosarzewski, LK;  Kramarik, L;  Kravtsov, P;  Krueger, K;  Mudiyanselage, NK;  Kumar, L;  Kumar, S;  Elayavalli, RK;  Kwasizur, JH;  Lacey, R;  Lan, S;  Landgraf, JM;  Lauret, J;  Lebedev, A;  Lednicky, R;  Lee, JH;  Leung, YH;  Li, C;  Li, W;  Li, X;  Li, Y;  Liang, Y;  Licenik, R;  Lin, T;  Lin, Y;  Lisa, MA;  Liu, F;  Liu, H;  Liu, P;  Liu, T;  Liu, X;  Liu, Y;  Liu, Z;  Ljubicic, T;  Llope, WJ;  Longacre, RS;  Lukow, NS;  Luo, S;  Luo, X;  Ma, GL;  Ma, L;  Ma, R;  Ma, YG;  Magdy, N;  Majka, R;  Mallick, D;  Margetis, S;  Markert, C;  Matis, HS;  Mazer, JA;  Minaev, NG;  Mioduszewski, S;  Mohanty, B;  Mooney, I;  Moravcova, Z;  Morozov, DA;  Nagy, M;  Nam, JD;  Nasim, M;  Nayak, K;  Neff, D;  Nelson, JM;  Nemes, DB;  Nie, M;  Nigmatkulov, G;  Niida, T;  Nogach, LV;  Nonaka, T;  Nunes, AS;  Odyniec, G;  Ogawa, A;  Oh, S;  Okorokov, VA;  Page, BS;  Pak, R;  Pandav, A;  Panebratsev, Y;  Pawlik, B;  Pawlowska, D;  Pei, H;  Perkins, C;  Pinsky, L;  Pinter, RL;  Pluta, J;  Porter, J;  Posik, M;  Pruthi, NK;  Przybycien, M;  Putschke, J;  Qiu, H;  Quintero, A;  Radhakrishnan, SK;  Ramachandran, S;  Ray, RL;  Reed, R;  Ritter, HG;  Rogachevskiy, OV;  Romero, JL;  Ruan, L;  Rusnak, J;  Sahoo, NR;  Sako, H;  Salur, S;  Sandweiss, J;  Sato, S;  Schmidke, WB;  Schmitz, N;  Schweid, BR;  Seck, F;  Seger, J;  Sergeeva, M;  Seto, R;  Seyboth, P;  Shah, N;  Shahaliev, E;  Shanmuganathan, PV;  Shao, M;  Sheikh, AI;  Shen, F;  Shen, WQ;  Shi, SS;  Shou, QY;  Sichtermann, EP;  Sikora, R;  Simko, M;  Singh, J;  Singha, S;  Smirnov, N;  Solyst, W;  Sorensen, P;  Spinka, HM;  Srivastava, B;  Stanislaus, TDS;  Stefaniak, M;  Stewart, DJ;  Strikhanov, M;  Stringfellow, B;  Suaide, AAP;  Sumbera, M;  Summa, B;  Sun, XM;  Sun, X;  Sun, Y;  Surrow, B;  Svirida, DN;  Szymanski, P;  Tang, AH;  Tang, Z;  Taranenko, A;  Tarnowsky, T;  Thomas, JH;  Timmins, AR;  Tlusty, D;  Tokarev, M;  Tomkiel, CA;  Trentalange, S;  Tribble, RE;  Tribedy, P;  Tripathy, SK;  Tsai, OD;  Tu, Z;  Ullrich, T;  Underwood, DG;  Upsal, I;  Van Buren, G;  Vanek, J;  Vasiliev, AN;  Vassiliev, I;  Videbaek, F;  Vokal, S;  Voloshin, SA;  Wang, F;  Wang, G;  Wang, JS;  Wang, P;  Wang, Y;  Wang, Z;  Webb, JC;  Weidenkaff, PC;  Wen, L;  Westfall, GD;  Wieman, H;  Wissink, SW;  Witt, R;  Wu, Y;  Xiao, ZG;  Xie, G;  Xie, W;  Xu, H;  Xu, N;  Xu, QH;  Xu, YF;  Xu, Y;  Xu, Z;  Yang, C;  Yang, Q;  Yang, S;  Yang, Y;  Yang, Z;  Ye, Z;  Yi, L;  Yip, K;  Zbroszczyk, H;  Zha, W;  Zhang, C;  Zhang, D;  Zhang, S;  Zhang, XP;  Zhang, Y;  Zhang, ZJ;  Zhang, Z;  Zhao, J;  Zhong, C;  Zhou, C;  Zhu, X;  Zhu, Z;  Zurek, M;  Zyzak, M
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ANISOTROPIC FLOW  ELLIPTIC FLOW  PB COLLISIONS  
High-Resolution Photoelectron Imaging and Photodetachment Spectroscopy of Cryogenically Cooled IO- 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2020, 卷号: 124, 期号: 28, 页码: 5720-5726
Authors:  Wang, YT;  Ning, CG;  Liu, HT;  Wang, LS
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DIPOLE-BOUND STATES  ELECTRON RESONANCE-SPECTRA  LASER-INDUCED FLUORESCENCE  MULTIPLY-CHARGED ANIONS  AUTODETACHMENT SPECTROSCOPY  PHYSICAL-PROPERTIES  EXCITED-STATES  IODINE OXIDE  BRO  PHOTODISSOCIATION  
Discontinuous transition between Zundel and Eigen for H5O2+* 期刊论文
CHINESE PHYSICS B, 2020, 卷号: 29, 期号: 8, 页码: -
Authors:  Wang, ED;  Zhu, BE;  Gao, Y
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SPECTRAL SIGNATURES  PROTON TRANSPORT  WATER CLUSTERS  EXCESS PROTON  REAL-SPACE  AB-INITIO  SPECTROSCOPY  H5O2+  
Decompression-Induced Diamond Formation from Graphite Sheared under Pressure 期刊论文
PHYSICAL REVIEW LETTERS, 2020, 卷号: 124, 期号: 6, 页码: -
Authors:  Dong, JJ;  Yao, Z;  Yao, MG;  Li, R;  Hu, K;  Zhu, LY;  Wang, Y;  Sun, HH;  Sundqvist, B;  Yang, K;  Liu, BB
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TOTAL-ENERGY CALCULATIONS  X-RAY  GLASSY-CARBON  TRANSFORMATION  TRANSITION  MECHANISM  GRAPHENE  GROWTH  
An oxygen vacancy-rich two-dimensional Au/TiO2 hybrid for synergistically enhanced electrochemical N2 activation and reduction 期刊论文
Journal of Materials Chemistry A, 2020, 卷号: 8, 期号: 14, 页码: 6586-6596
Authors:  Zhao, Sen;  Liu, Han-Xuan;  Qiu, Yu;  Liu, Shuang-Quan;  Diao, Jin-Xiang;  Chang, Chun-Ran;  Si, Rui;  Guo, Xiao-Hui
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Gold compounds  Ammonia  Catalyst selectivity  Chemical activation  Electrocatalysts  Electronic structure  Nitrogen  Oxide minerals  Oxygen  Oxygen vacancies  Reduction  Titanium dioxide  Electrocatalytic activity  Electron  donating effects  Faradaic efficiencies  Nitrogen reduction  Rate  limiting steps  Reversible hydrogen electrodes  Technical challenges  Theoretical calculations