Zobrazeno 1 - 10
of 137
pro vyhledávání: '"Han‐Shi Hu"'
Autor:
Zejie Fei, Jia-Qi Wang, Rulin Tang, Yuzhu Lu, Changcai Han, Yongtian Wang, Jing Hong, Changwu Dong, Han-Shi Hu, Xiao-Gen Xiong, Chuangang Ning, Hongtao Liu, Jun Li
Publikováno v:
Nature Communications, Vol 14, Iss 1, Pp 1-8 (2023)
Abstract Nitrogen has five valence electrons and can form a maximum of three shared electron-pair bonds to complete its octet, which suggests that its maximum bond order is three. With a joint anion photoelectron spectroscopy and quantum chemistry in
Externí odkaz:
https://doaj.org/article/30f8ef4d29d94711898f0962f224716c
Publikováno v:
npj Computational Materials, Vol 9, Iss 1, Pp 1-11 (2023)
Abstract Quantum computing has shown great potential in various quantum chemical applications such as drug discovery, material design, and catalyst optimization. Although significant progress has been made in the quantum simulation of simple molecule
Externí odkaz:
https://doaj.org/article/6e081af2fab94804942eb8f0c681ab1a
Autor:
Zejie Fei, Jia-Qi Wang, Rulin Tang, Yuzhu Lu, Changcai Han, Yongtian Wang, Jing Hong, Changwu Dong, Han-Shi Hu, Xiao-Gen Xiong, Chuangang Ning, Hongtao Liu, Jun Li
Publikováno v:
Nature Communications, Vol 14, Iss 1, Pp 1-1 (2023)
Externí odkaz:
https://doaj.org/article/a3f63a4c2d984111b28b3db45b8337ca
Autor:
Gang Li, Yang-Yang Zhang, Qinming Li, Chong Wang, Yong Yu, Bingbing Zhang, Han-Shi Hu, Weiqing Zhang, Dongxu Dai, Guorong Wu, Dong H. Zhang, Jun Li, Xueming Yang, Ling Jiang
Publikováno v:
Nature Communications, Vol 11, Iss 1, Pp 1-6 (2020)
Spectroscopic studies of water clusters provide insight into the hydrogen bond structure of water and ice. The authors measure infrared spectra of neutral water octamers using a threshold photoionization technique based on a tunable vacuum-UV free el
Externí odkaz:
https://doaj.org/article/31096579e541445588d7cf2a0d44db14
Autor:
Yang-Yang Zhang, Chong Wang, Gang Li, Xiangyu Zang, Yong Yu, Han-Shi Hu, Jiayue Yang, Weiqing Zhang, Dongxu Dai, Guorong Wu, Ling Jiang, Xueming Yang, Jun Li
Publikováno v:
Cell Reports Physical Science, Vol 3, Iss 2, Pp 100748- (2022)
Summary: As a key species in understanding the hydrogen-bonding network transitions between liquid water and ice, the neutral water heptamer is a challenging experimental target, owing to the richness of low-lying isomers. Here, we report the size-sp
Externí odkaz:
https://doaj.org/article/47b9a12e16f747f8a314f1ac280fd4f8
Autor:
Chaoxian Chi, Jia-Qi Wang, Han-Shi Hu, Yang-Yang Zhang, Wan-Lu Li, Luyan Meng, Mingbiao Luo, Mingfei Zhou, Jun Li
Publikováno v:
Nature Communications, Vol 10, Iss 1, Pp 1-6 (2019)
While main group elements possess four valence orbitals that are accessible for bonding, quadruple bonding to main group elements is very rarely observed. Here the authors report that boron is able to form four bonding interactions with iron in the B
Externí odkaz:
https://doaj.org/article/697189b1e61349ebbdeff8876bc4d099
Autor:
Jin-Cheng Liu, Hai Xiao, Xiao-Kun Zhao, Nan-Nan Zhang, Yuan Liu, Deng-Hui Xing, Xiaohu Yu, Han-Shi Hu, Jun Li
Publikováno v:
CCS Chemistry. 5:152-163
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::25e64e7436cf40ba1ded7d57da5587cf
https://doi.org/10.31635/ccschem.022.202201796
https://doi.org/10.31635/ccschem.022.202201796
Publikováno v:
Angewandte Chemie. 135
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::893babc731a8bb334dd436bacf69b346
https://doi.org/10.1002/ange.202301764
https://doi.org/10.1002/ange.202301764
Publikováno v:
Journal of Computational Chemistry. 44:190-198
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::218fd75a91ffe58b21bfb47f60cc0856
https://doi.org/10.1002/jcc.26856
https://doi.org/10.1002/jcc.26856
Autor:
Zhipeng Wang, Jun-Bo Lu, Xue Dong, Qiang Yan, Xiaogui Feng, Han-Shi Hu, Shuao Wang, Jing Chen, Jun Li, Chao Xu
Publikováno v:
Journal of the American Chemical Society. 144:6383-6389
Lanthanide/actinide separation is a worldwide challenge for atomic energy and nuclear waste treatment. Separation of americium (Am), a critical actinide element in the nuclear fuel cycle, from lanthanides (Ln) is highly desirable for minimizing the l
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::c64e093dfcaa86d9d8a838be549a6904
https://doi.org/10.1021/jacs.2c00594
https://doi.org/10.1021/jacs.2c00594