What software is used for simulation of the Boron Nitride nanocages??

More Masoome Sheikhi's questions See All

Can anyone explain about Resazurin assay calculation?

I use the following equation to calculate: Percentage difference between treated and control cells = (O2 x A1) - (O1 x A2) (O2 x P1) - (O1 x P2) x100 Where: O1 = molar extinction...

02 October 2023 2,762 2 View

How can I set 2 surface boundary conditions like heat-flux at 2 different times for a transient heat transfer simulation?

I wanted to simulate a 4-cylinder engine transient heat transfer. Because the combustion in cylinders has delay and not at the same time, I wanted to give different times for setting heat-flux on...

14 November 2022 8,473 5 View

How can I change PDI to a statistical definition (like standard deviation) for using as an error bar ?

I have some molecular weight data and I need a statistical definition for PDI to use as error bar.

12 September 2022 3,031 0 View

Cavity Expansion Theory?

Hi everybody I am working on cavity expansion theory. When I try to solve the equations in compressible mode by using the Ronge Kutta method after a velocity of 900 m/s the non-dimensional stress...

27 August 2021 9,259 2 View

Why the universe formed although anything happens to increase disorder?

i mean, i know that its classic rols and thats modern physics, but... why? it can be metaphysics, because for example We all have to die, but something called motivation for survival takes us in...

10 February 2020 1,073 5 View

How we can apply FRP in Concrete beam with Abaqus?

Hello all, I want to modelling a Concrete Beam with ABAQUS, My intention is that first beam cracked and then the FRP, apply to beam and analysis continue. can you help me?

11 January 2017 9,121 6 View

Dose any body have some information on Patent application process?

I am planning to submit my patent application but some of the investor's companies suggest me to buy the formulation instead of waiting for results several years and also if it failed for...

29 September 2016 8,044 7 View

Any ideas regarding the brand of the country in the world tourism market?

Dear All, I am looking for some experiences regarding the national brand for tourism development and marketing. How a country with diverse ethnic groups can show the real image of the country in...

21 October 2015 7,540 5 View

what is the stamp of NaNO3 in hummer's method to synthesize chemically derived graphene?

Can we omit it? Or can we use HNO3 instead of it?

16 January 2013 8,338 3 View

Dispersion of nanographene: does anybody have experience with it?

I am trying to disperse nano multilayer graphene in a epoxy and pu resins, without grafting any chemical functionalization. I've been using two protocols: one based on straight dispersion of nano...

15 January 2013 5,106 11 View

How can microbial engineering techniques be used to enhance the functionality and efficacy of probiotics ?

through genetic modification or metabolic engineering? Is it helpful, good for health ?

22 July 2024 7,811 4 View

How to carry out survival analysis of a one time use machine which is stored and tested at regular intervals for functionality?

I want to carry out reliability study of a machine with various sub components both electrical and mechanical. The machine is a one time use (similar to a decoy or rocket) and is stored at...

30 June 2024 2,435 0 View

How to know if the oil palm tree is functioning properly in terms of absorption of different nutrient?

The idea is to design an IoT system that is able to capture real-time conditions from an oil palm tree to ensure optimal growth. Nutrients such as Sulfur, Nitrogen, Boron, Zinc, Copper and Iron.

30 June 2024 3,046 2 View

Why after DFT energy calculation in dmol3 materials studio 2023, it does not give me the outmol file?

I used material studio app dmol3 module for geometry optimization for a nanotube, and then I calculated its energy, for some of gas phases and I actually had the outmol file which allows me to...

14 June 2024 5,636 0 View

How to purify boronate esters?

How to purify boron esters? Hello. I'm synthesizing borates in my lab. My questions are as follows: 1. How to purify boronate esters like B(OR)3 compounds, and it is a UV undetected...

23 May 2024 7,072 2 View

What method is good for doing in vitro degradation study of PCL microsphere by change in weight calculation or change in diameter (from microscope)?

I have prepared some polymeric microspheres from chitosan and PCL. However while performing in vitro degradation study, I found difficulties in both above mentioned methods. Here I am mentioning...

20 May 2024 6,114 4 View

Request a research paper?

Hello, Can I get an article titled " Functionalized 1,3,5-triazine derivatives as components for photo- and electroluminescent materials" with thanks for all.

16 May 2024 7,918 4 View

Please advise about 2D elemental phosphorene antimonene boron nanoparticles in dentistry?

Please advise about 2D elemental phosphorene antimonene boron nanoparticles in dentistry

16 May 2024 5,820 0 View

Release of drug from NPs?

I have loaded mesoporous silica nanoparticles with a drug and attached them to antibodies but after conjugation with antibodies, the nanoparticles loaded with the drug lose their functionality to...

12 May 2024 4,691 1 View

What features and functionalities should a mobile app for construction site hazard monitoring and reporting in Ghana have to ensure its adoption?

This question aims to gather ideas on the essential features and functionalities that a mobile app for construction site hazard monitoring and reporting in Ghana should have to ensure its adoption...

09 May 2024 9,448 0 View

Morteza Jamshidi

Hi dear Masoome Sheikhi

There is a wide range of softwares and codes that you can use them. It depends you that what type of data are needed? If you need to periodic calculation you should use Wien2k , quantum espresso or ATK. Moreover, for molecular properties Gaussian , Gamess and spartan are good choice that they are under Windows.

Pervaiz Ahmad

Dear Masoome Sheikhi

The most common in these days are DFT and Wein 2k.

Hossein Karimian

how I can draw B12N12 nanocage?