Search Results - "Huang, Haibei"

Relay-Like Exchange Mechanism through a Spin Radical between TbPc2 Molecules and Graphene/Ni(111) Substrates by Marocchi, Simone, Candini, Andrea, Klar, David, Van den Heuvel, Willem, Huang, Haibei, Troiani, Filippo, Corradini, Valdis, Biagi, Roberto, De Renzi, Valentina, Klyatskaya, Svetlana, Kummer, Kurt, Brookes, Nicholas B, Ruben, Mario, Wende, Heiko, del Pennino, Umberto, Soncini, Alessandro, Affronte, Marco, Bellini, Valerio

“…We investigate the electronic and magnetic properties of TbPc2 single ion magnets adsorbed on a graphene/Ni(111) substrate, by density functional theory (DFT),…”
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Effect of Paramagnetic Open-Shell Gadolinium(III) Texaphyrin on Its Kinetics and Electronic Structures in Fluorescence and Phosphorescence Emission States by Huang, Haibei, Bu, Yuxiang

“…The paramagnetic effect, which was often found to quench the fluorescence and decrease the phosphorescence radiative lifetime, has not been quantitatively…”
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Multifunctional Roles of Clathrate Hydrate Nanoreactors for CO2 Reduction by Huang, Haibei, Xue, Lijuan, Bu, Yuxiang

“…In this study, we explore a possible platform for the CO2 reduction (CO2R) in one of water's solid phases, namely clathrate hydrates (CHs), by ab initio…”
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Multifunctional Roles of Clathrate Hydrate Nanoreactors for CO 2 Reduction by Huang, Haibei, Xue, Lijuan, Bu, Yuxiang

“…Abstract In this study, we explore a possible platform for the CO 2 reduction (CO 2 R) in one of water's solid phases, namely clathrate hydrates (CHs), by ab…”
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Symmetry-Breaking Manipulated Channel Ergodicity in Intramolecular Singlet Fission Uncovered Statistically by Molecular Dynamics Samplings by Xue, Lijuan, Huang, Haibei, Wu, Suqing, Song, Xinyu, Lu, Gang, Cheng, Shibo, Bu, Yuxiang

“…Persistent structure dynamics of chromophores in a solvent has a pivotal influence on singlet fission (SF) phenomena through breaking structure symmetry and…”
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Multifunctional Roles of Clathrate Hydrates Nanoreactors for CO2 Reduction by Huang, Haibei, Xue, Lijuan, Bu, Yuxiang

“…In this study, we explore a possible platform for the CO2 reduction (CO2R) in one of water's solid phases, namely clathrate hydrates (CHs), by ab initio…”
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Magnetic Dioxygen Clathrate Hydrates: A Type of Promising Building Blocks for Icy Crystalline Materials by Zhang, Hongshu, Huang, Haibei, Gao, Liang, Fu, Qiang, Cheng, Shibo, Bu, Yuxiang

“…Clathrate hydrates (CHs) have recently attracted considerable research interest in fundamental science and practical applications because guest molecules with…”
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Hydroxide-Enhanced Superexchange Magnetic Couplings in Ionic Clathrate Hydrates by Zhang, Hongshu, Huang, Haibei, Gao, Liang, Xue, Lijuan, Feng, Yiwei, Song, Xinyu, Bu, Yuxiang

“…The guest-driven magnetic properties of clathrate hydrates (CHs) has a promising application prospect as a new type of icy magnetic material, but it meets more…”
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Relay-Like Exchange Mechanism through a Spin Radical between TbPc 2 Molecules and Graphene/Ni(111) Substrates by Marocchi, Simone, Candini, Andrea, Klar, David, Van den Heuvel, Willem, Huang, Haibei, Troiani, Filippo, Corradini, Valdis, Biagi, Roberto, De Renzi, Valentina, Klyatskaya, Svetlana, Kummer, Kurt, Brookes, Nicholas B, Ruben, Mario, Wende, Heiko, Del Pennino, Umberto, Soncini, Alessandro, Affronte, Marco, Bellini, Valerio

“…We investigate the electronic and magnetic properties of TbPc single ion magnets adsorbed on a graphene/Ni(111) substrate, by density functional theory (DFT),…”
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Lanthanide-radical magnetic coupling in [LnPc$_2$]$^0$: Competing exchange mechanisms captured via ab initio multi-reference calculations by Huang, Haibei, Heuvel, Willem Van den, Soncini, Alessandro

“…Quantum Materials Research 2020; 1:e200003 Special Issue "SMM in memory of Prof A. Bencini" We present a computational investigation of the intramolecular…”
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