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The Fukui function is named after Kenichi Fukui, who investigated the frontier orbitals described by the function, specifically the HOMO and LUMO. [3] Fukui functions are related in part to the frontier molecular orbital theory (also known as the Fukui theory of reactivity and selection, also developed by Kenichi Fukui) which discusses how nucleophiles attack the HOMO while at the same time ...
In 1952, Kenichi Fukui published a paper in the Journal of Chemical Physics titled "A molecular theory of reactivity in aromatic hydrocarbons." [1] Though widely criticized at the time, he later shared the Nobel Prize in Chemistry with Roald Hoffmann for his work on reaction mechanisms.
Kenichi Fukui (福井 謙一, Fukui Ken'ichi, October 4, 1918 – January 9, 1998) was a Japanese chemist. [1] He became the first person of East Asian ancestry to be awarded the Nobel Prize in Chemistry when he won the 1981 prize with Roald Hoffmann , for their independent investigations into the mechanisms of chemical reactions .
Yang's main contributions to theoretical chemistry range from fundamental theory to applications of density functional theory. He (with Parr) developed the concepts of the Fukui function, [1] hardness, and softness [2] in density functional theory. He also justified the theoretical ground of potential functional (as in Optimized-Effective ...
Calligra Sheets (formerly KSpread and Calligra Tables) is a free software spreadsheet application that is part of Calligra Suite, an integrated graphic art and office suite developed by KDE.
Kenichiro Fukui (福井 健一郎, Fukui Ken'ichirō) is a Japanese video game composer and electronic musician. Before working at Square Enix, he was employed at Konami. He was also an arranger and a keyboardist in the band The Black Mages. Additionally, Fukui arranged Angela Aki's "Kiss Me Good-Bye" from Final Fantasy XII.
SymPy is simple to install and to inspect because it is written entirely in Python with few dependencies. [4] [5] [6] This ease of access combined with a simple and extensible code base in a well known language make SymPy a computer algebra system with a relatively low barrier to entry.
spaCy (/ s p eɪ ˈ s iː / spay-SEE) is an open-source software library for advanced natural language processing, written in the programming languages Python and Cython. [3] [4] The library is published under the MIT license and its main developers are Matthew Honnibal and Ines Montani, the founders of the software company Explosion.