gaussian 09 software package (Fukui Bank Ltd)
90
Structured Review
Fukui Bank Ltd
gaussian 09 software package
Gaussian 09 Software Package, supplied by Fukui Bank Ltd, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/gaussian+09+software+package/gaussian+09/pm37951380-67-29-44
Average 90 stars, based on 1 article reviews
Gaussian 09 Software Package, supplied by Fukui Bank Ltd, used in various techniques. Bioz Stars score: 90/100, based on 1 PubMed citations. ZERO BIAS - scores, article reviews, protocol conditions and more
https://www.bioz.com/product/gaussian+09+software+package/gaussian+09/pm37951380-67-29-44
Average 90 stars, based on 1 article reviews
gaussian 09 software package - by Bioz Stars,
2026-11
90/100 stars
Images
Related Articles
Activation Assay:Article Title: Electrooxidation of chlorophene and dichlorophen by reactive electrochemical membrane: Key determining factors of removal efficiency. Article Snippet: This study systematically investigated the variable main electrooxidation mechanism of chlorophene (CP) and dichlorophen (DCP) with the change of reaction conditions at Ti4O7 anode operated in batch and reactive electrochemical membrane (REM) modes.. Significant degradation of CP and DCP was observed, that is, CP exhibited greater removal efficiency in batch mode at 0.5–3.5 mA cm 2 and REM operation (0.5 mA cm 2) with a permeate flow rate of 0.85 cm min 1 under the same reaction conditions, while DCP exhibited a faster degradation rate with the increase of current density in REM operation.. Density functional theory (DFT) simulation and electrochemical performance tests indicated that the electrooxidation efficiency of CP and DCP in batch mode was primarily affected by the mass transfer rates. Software:Article Title: Electrooxidation of chlorophene and dichlorophen by reactive electrochemical membrane: Key determining factors of removal efficiency. Article Snippet: This study systematically investigated the variable main electrooxidation mechanism of chlorophene (CP) and dichlorophen (DCP) with the change of reaction conditions at Ti4O7 anode operated in batch and reactive electrochemical membrane (REM) modes.. Significant degradation of CP and DCP was observed, that is, CP exhibited greater removal efficiency in batch mode at 0.5–3.5 mA cm 2 and REM operation (0.5 mA cm 2) with a permeate flow rate of 0.85 cm min 1 under the same reaction conditions, while DCP exhibited a faster degradation rate with the increase of current density in REM operation.. Density functional theory (DFT) simulation and electrochemical performance tests indicated that the electrooxidation efficiency of CP and DCP in batch mode was primarily affected by the mass transfer rates. Article Title: Theoretical research on cage-like furazan-based energetic compounds and its derivatives. Article Snippet: In this manuscript, we reported the design and prediction of two furazan-based cage-like molecules and their derivatives using density function theory (DFT).. The heat formation and detonation properties were calculated using Hess’s law and KamletJacobs equations with the B3PW91method.. The molecular stability and geometry were analyzed using theM06-2Xmethod, and molecular crystal structures were predicted based onMonte Carlo simulation, while chemical reactive sites were judged using the PBE0 method based on Fukui function. |