I need to carryout analysis of the sample on Py-GC-MS but can not find an analytical facility for the same. Please help.
I am searching for the same. Do you get that Py-GC-MS analysis facility in Gujarat or India.
Is there any specific method to calculate raman spectra using vasp?
10 June 2024 872 1 View
I have calculated specific capacitance of the supercapacitor system but how can I calculate the energy density if I have data for capacitance at each provided voltage
10 May 2024 5,297 0 View
Please suggest how many rodents required for any study wild type rodents
04 April 2024 4,483 0 View
This study aims to investigate motivational tactics suitable for elementary classrooms, emphasizing their crucial role in shaping students' attitudes towards learning. It acknowledges the...
18 March 2024 7,625 1 View
As we know, for Raman spectroscopy, a change in dielectric constant is required w.r.t. phonons, which does not apply to metals. Therefore, pure metals are Raman inactive. Also, this 1000 cm-1 peak...
02 March 2024 1,856 4 View
I wanted to simulate ionic liquids using OPLS all atom force field unable to find the angle coefficients for the cations . can someone help me out?
29 December 2023 2,300 2 View
Vibrating wire instruments are installed for health monitoring during dam construction. But, with time, most instruments stop working and are useless. The continuous health monitoring of the dam...
04 December 2023 9,461 4 View
Via MD simulations we have calculated integral capacitance for one electrode in a super capacitor system. Is it possible to calculate the energy density using this?
04 December 2023 1,794 1 View
Dear all, Can anybody help me to correctly write the Damper Location Matrix for a high rise building where dampers are provided at all floors. Thanks in advance From Bhargav
03 December 2023 2,310 2 View
Dear sirs, I am working on high rise buildings. To determine the response (displacement, velocities, acceleration) State Space Method is used in MATLAB model. Can anybody help me to properly...
01 December 2023 9,719 2 View
I'm currently working on calculating the collision cross section (CCS) for various ions, and I'm facing challenges when dealing with sodiated and multiply charged ions. Most of the resources I’ve...
08 August 2024 8,329 0 View
I am currently working on a project involving liposomes and need to determine the maximum volume of siRNA that can be added to a 2.5 mL liposome solution with a total lipid concentration of 10...
30 July 2024 6,420 1 View
Dear Siesta Users, I installed Siesta 5.0.1 and I want to use Grimme's D3 correction. According to the 5.0.1 manual, I could use a few parameters to include the D3 correction in the...
27 July 2024 5,748 0 View
It has been long known that EDC carbodiimide and NHS easter's half life agains hydrolysis are highly related to pH. However, very surprisingly, not yet found a paper giving a table/chart of their...
25 July 2024 8,738 0 View
I run mechanochemical reactions that involves the use of a large amount of catalyst (1:1 molar ratio to the reactant). When I try to understand the effect of amount of catalyst on the reaction, I...
23 July 2024 9,938 1 View
Hi, I am a PhD student working at Jagiellonian University, Faculty of Chemistry. My work is related to the development of new analytical methods for the quantification of short-chain fatty acids...
22 July 2024 5,492 6 View
Dear Researchers, My question is associated with the "MDCI" method in Orca. Please let me clarify my question using a simple example: Suppose we are going to perform CBS extrapolation using "!...
21 July 2024 1,632 0 View
what are the main points
10 July 2024 9,236 5 View
Hello dear colleagues and professors Please what is the recommended type of pseudopotentials for QE? ultrasoft or norm conserving?? And from where get all types of pseudos (us, nc, pbe,...
09 July 2024 9,541 5 View
Hi, Just curious to know that in chromatography, a chromatogram should be zoomed to what scale? 10 times of output , 50X or ..? Is there any regulation or general chapter which describes this?...
03 July 2024 3,119 6 View