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Aug 15, 2024 · How many individual frames per run, how many runs in total, their start and end parameter are needed to collect data …

Nov 28, 2017 · For more on how to run these types of calculations, see Finding transition states in Gaussian – focus: Electrophilic …

Apr 14, 2016 · I would like to perform a relaxed scan in Gaussian09 on my molecule using the modredundant optimization. Because I …

Sep 16, 2015 · I run graphite plate electrodes (anodes), to avoid consuming them I try to stay below 15A/square foot, much depends …

Sep 1, 2014 · Here is the excerpt of my lab manual: "Simple distillation is more useful for purifying a liquid that contains either a non …

Aug 29, 2016 · Just few suggestions for finding a stationary point. You can add some additional angular flexibility into the basis by …

Jun 22, 2019 · There is a nontrivial competition between the yield per run and the time to make a run. Specifically, if ΔH Δ H …

Sep 24, 2015 · What is the internal energy when a reaction is run at constant volume and $9.19\ \mathrm {kJ}$ of heat is absorbed, …

Mar 6, 2019 · Recently, I have started to learn about nuclear magnetic resonance (NMR) in school and something which I cannot …

May 29, 2016 · A non-polar molecule X is analyzed by TLC chromatography on silica to determine its Rf R f ${R}_{f}$ value. The first …