| 两侧同时换到之前的修订记录前一修订版后一修订版 | 前一修订版 |
| adf:bondanalysis [2024/01/09 13:21] – [2023] liu.jun | adf:bondanalysis [2024/04/13 22:53] (当前版本) – [2024] liu.jun |
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| [[adf:publishedpapers|上级目录]] | [[adf:publishedpapers|上级目录]] |
| ======配合物/分子间相互作用/化学键分析[目录]====== | ======配合物/分子间相互作用/化学键分析[目录]====== |
| | - 【香港大学支志明教授课题组】多核d$^{10}$金属团簇中的各向异性金属-金属泡利排斥，J. Phys. Chem. Lett. 2024, 15, XXX, [[https://pubs.acs.org/doi/abs/10.1021/acs.jpclett.3c03434#|2193–2201]] |
| | - [[https://www.fermitech.com.cn/news/adfhighlight202399|10-和14-价电子三键体系：由dδ4环区分的等电子族]], Inorg. Chem. 2023, 62, 51, 21083–21090 |
| - 【国内课题组】ThN中不寻常的氮四重键, Nature Communications, 2023, [[https://www.nature.com/articles/s41467-023-43208-z|volume 14, Article number: 7677]] | - 【国内课题组】ThN中不寻常的氮四重键, Nature Communications, 2023, [[https://www.nature.com/articles/s41467-023-43208-z|volume 14, Article number: 7677]] |
| - 【国内课题组】全金属富勒烯：[K@Au$_{12}$Sb$_{20}$]$^{5−}$, **SCIENCE**, 2023, [[https://www.science.org/doi/abs/10.1126/science.adj6491|Vol 382, Issue 6672, pp. 840-843]] | - 【国内课题组】全金属富勒烯：[K@Au$_{12}$Sb$_{20}$]$^{5−}$, **SCIENCE**, 2023, [[https://www.science.org/doi/abs/10.1126/science.adj6491|Vol 382, Issue 6672, pp. 840-843]] |
| =====其他===== | =====其他===== |
| ====2024==== | ====2024==== |
| | - 磷酸盐、氧化膦和磷酰胺配体与Th(IV)的相互作用, Results in Chemistry, Available online 11 April 2024, 101498, DOI: [[https://www.sciencedirect.com/science/article/pii/S2211715624001942|10.1016/j.rechem.2024.101498]] |
| | - 微溶剂化苯甲腈与水/氨配合物在冰粒形成附近的光化学, Chemical Physics, 2024, 112293, DOI: [[https://www.sciencedirect.com/science/article/abs/pii/S0301010424001228|10.1016/j.chemphys.2024.112293]] |
| | - KNiF3模型化合物的化学键合、10Dq参数和超交换, ChemPhyChem, 2024, DOI: [[https://chemistry-europe.onlinelibrary.wiley.com/doi/abs/10.1002/cphc.202400006|10.1002/cphc.202400006]] |
| | - 通用的三元金属螯合剂TMACH-1,2-HOPO的络合、溶液热力学、光谱DFT研究, J Incl Phenom Macrocycl Chem, 2024, DOI: [[https://link.springer.com/article/10.1007/s10847-024-01221-9|10.1007/s10847-024-01221-9]] |
| | - 有机金属锡单硫族化合物[SnX(X=O、S、Se和Te)]作为羰基化合物的替代配体：DFT研究, Computational and Theoretical Chemistry, Volume 1233, March 2024, 114514, DOI: [[https://www.sciencedirect.com/science/article/abs/pii/S2210271X24000537|10.1016/j.comptc.2024.114514]] |
| | - 全碳氢化合物配位的超原子金/铝簇合物, Inorg. Chem., 2024, DOI: [[https://pubs.acs.org/doi/full/10.1021/acs.inorgchem.3c03790|10.1021/acs.inorgchem.3c03790]] |
| | - EDA-NOCV分析揭示金属-芳基配合物的成键场景, Organometallics, 2024, DOI: [[https://pubs.acs.org/doi/abs/10.1021/acs.organomet.3c00406|10.1021/acs.organomet.3c00406]] |
| | - 环烷基（氨基）卡宾诱导磷酸镓重排反应, [[https://chemistry-europe.onlinelibrary.wiley.com/doi/pdf/10.1002/ejic.202300622|Eur. J. Inorg. Chem. 2024, e202300622]] |
| - In Vitro and In Silico Studies on Benzimidazole-Based Compounds, ChemistrySelect, 2024, DOI:[[https://chemistry-europe.onlinelibrary.wiley.com/doi/abs/10.1002/slct.202304347|10.1002/slct.202304347]] | - In Vitro and In Silico Studies on Benzimidazole-Based Compounds, ChemistrySelect, 2024, DOI:[[https://chemistry-europe.onlinelibrary.wiley.com/doi/abs/10.1002/slct.202304347|10.1002/slct.202304347]] |
| ====2023==== | ====2023==== |
