المؤلفون: Xiang Li, Jia-Cheng Huang, Guang-Ze Zhang, Hao-En Li, Chang-Su Cao, Dingshun Lv, Han-Shi Hu

مصطلحات موضوعية: Biophysics, Medicine, Space Science, Biological Sciences not elsewhere classified, Mathematical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, Information Systems not elsewhere classified, variational monte carlo, nonstochastic optimization algorithm, network quantum states, important configurations simultaneously, entire optimization process, body wave functions, superior accuracy compared, nqs offers comparable, efficiency compared, vmc framework, vmc ), thereby accelerating, stochastic counterpart, stable convergence, selected set, second quantization, opens avenues, method bypasses, future enhancements, energy evaluation, encode many, deterministically generates, chemical systems

Relation: https://figshare.com/articles/journal_contribution/A_Nonstochastic_Optimization_Algorithm_for_Neural-Network_Quantum_States/24648034

الاتاحة: https://doi.org/10.1021/acs.jctc.3c00831.s001
https://figshare.com/articles/journal_contribution/A_Nonstochastic_Optimization_Algorithm_for_Neural-Network_Quantum_States/24648034

المؤلفون: Xue-Lian Jiang (2462422), Cong-Qiao Xu (1468828), Jun-Bo Lu (2562907), Chang-Su Cao (8912015), Hubert Schmidbaur (2651485), W. H. Eugen Schwarz (10867317), Jun Li (6494)

مصطلحات موضوعية: Biochemistry, Physiology, Biotechnology, Chemical Sciences not elsewhere classified, concept, MnO 3 F, ambient conditions, quasi-relativistic density-functional, p 6, oxide ligands, autocatalyzed release, Bh -6d, light Mn -3d species, MnO 3 X, gas phase, oxidation numbers, 24 trioxide halide molecules MO 3 X, decay mode, Electronic Structure, Ts -7p elements, n O 2, Spectroscopic Properties, ab initio, manganese group, closed-shell Lewis-type single-conf.

Relation: https://figshare.com/articles/journal_contribution/Electronic_Structure_and_Spectroscopic_Properties_of_Group_7_Tri-Oxo-Halides_MO_sub_3_sub_X_M_Mn_Bh_X_F_Ts_/14818388

الاتاحة: https://doi.org/10.1021/acs.inorgchem.1c00626.s001

المؤلفون: Chang-Su Cao¹, Jing Zhao¹, Han-Shi Hu¹, Schwarz, W. H. Eugen^1,2 eugen.schwarz@uni-siegen.de, Jun Li^1,3 junli@tsinghua.edu.cn

المصدر: Proceedings of the National Academy of Sciences of the United States of America. 10/24/2023, Vol. 120 Issue 43, p1-5. 42p.

مصطلحات موضوعية: *PERIODIC law, *HEAVY elements, *VALENCE fluctuations, *CONDUCTION electrons, *ATOMIC number

المؤلفون: Ying-Rui Lu, Qihua Xiong, Zehua Hu, Shibo Xi, Yanqiang Huang, Chang Su Cao, Junhu Wang, Jun Li, Ting-Shan Chan, Weizheng Cai, Hao Ming Chen, Tao Zhang, Shu Miao, Wei Xu, Hongbin Yang, Xuning Li, Jiyong Zhao, Sung Fu Hung, Hai Xiao, Bin Liu, Alexandre I. Rykov, Esen E. Alp

المصدر: Chem. 6:3440-3454

مصطلحات موضوعية: Reaction mechanism, Materials science, General Chemical Engineering, 02 engineering and technology, Electronic structure, 010402 general chemistry, Electrocatalyst, Photochemistry, 01 natural sciences, Biochemistry, Catalysis, symbols.namesake, Materials Chemistry, Environmental Chemistry, Moiety, biology, Biochemistry (medical), Active site, General Chemistry, 021001 nanoscience & nanotechnology, 0104 chemical sciences, biology.protein, symbols, Electron configuration, 0210 nano-technology, Raman spectroscopy

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::cc421c9b052455d9071b480f67fc594a
https://doi.org/10.1016/j.chempr.2020.10.027

المؤلفون: Xiao-Kun Zhao, Chang-Su Cao, Jin-Cheng Liu, Jun-Bo Lu, Jun Li, Han-Shi Hu

المصدر: Chemical science. 13(29)

مصطلحات موضوعية: General Chemistry

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::34302509c507a57655babaea639e275c
https://pubmed.ncbi.nlm.nih.gov/35974750

المؤلفون: Xue-Lian, Jiang, Cong-Qiao, Xu, Jun-Bo, Lu, Chang-Su, Cao, Hubert, Schmidbaur, W H Eugen, Schwarz, Jun, Li

المصدر: Inorganic chemistry. 60(13)

URL الوصول: https://explore.openaire.eu/search/publication?articleId=pmid________::0a8ea10f89341d08afa50fb913759ff8
https://pubmed.ncbi.nlm.nih.gov/34152757