01 January 1970 2 7K Report

Is there any specific unit or iso value of absorption or oscillator strength in UV or CD spectrum for plasmonics calculation?

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Which climatic threats are most pronounced within the African continent?

Parts of East and Southern Africa, in particular, have experienced severe droughts, leading to water shortages, crop failures, and food insecurity. On the other hand, intense rainfall events have...

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How to predict the Guanine quadruplet repeats in bacterial genome?

I would like to predict the Guanine quadruplet repeats in bacterial genome. However, available tools predict different outputs, leading to conflicting results. Could someone please explain the...

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How to perform solvent phase calculation using n-octanol as solvent in Gaussian?

Hello Everyone I am trying to perform a solvent phase calculation using n-octanol in Gaussian CPCM model. In Gaussian website I find the following information: SPECIFYING THE SOLVENT The solvent...

26 June 2023 2,722 0 View

In GWAS Analysis, my top most significant SNPs from pre-imputation data does not hold significance, post imputation data.Why? How do I justify this?

I am performing a GWAS Analysis, while comparing my pre-imputation and post-imputation data, I observed that the most significant genetic variant (p

27 September 2022 2,438 2 View

Trapping of intermediate?

How can i trap acetaldehyde in reaction medium as intermediate?

04 August 2022 361 1 View

How to calculate photovoltaic properties from DFT calculation?

Can anyone help me understanding the calculation of photovoltaic properties from DFT calculation? After going through several research paper I am not able to understand how to get the data from...

02 October 2021 6,555 1 View

How can i prove the cis to trans conversion of metal complex by refluxing?

I have two crystal structure of metal complexes one is cis and other is trans. Cis isomer is predominantly formed in room temperature over trans isomer.But when i reflux cis isomer in ethanol its...

18 September 2021 2,356 1 View

How can I apply a alternating or oscillatory electric field in Gaussian software?

Please anyone suggest me the proper comment related to implementation of Alternating / rotating electric field like E=E0 Sin wt in Gaussian 09 program.

13 September 2021 922 0 View

Is there any way to calculate Generalized Mullikan-Hush (GMH) Electronic Coupling value using gaussian 09?

I am trying to get the Generalized Mullikan-Hush Electronic Coupling value for electron transfer reactions. I have found it possible to do that using Q-Chem software. However, I am curious to know...

14 July 2021 3,583 3 View

How can I analyze the BOMD data coming from Gaussian out file?

I have calculated BOMD study in Gaussian 09 using command BOMD/ADMP. Now, how can I analyze the data coming from Gaussian out file?

03 July 2021 4,650 3 View

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Could dyes amplify the spectrum of light to a specific wavelength?

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Can a Conventional 50W visible LED Lamp Emit UV Light?

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Is artifacts in XPS possible to build high deviation in binding energy larger than 5 eV??

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There is possible way to calculate experimental DOS from the UPS spectrum of the material. How to calculate the DOS from UPS?

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