How can I calculate the rdf of water molecules around 'Na' ions that are closest(adsorbed) to the nanoparticle(solute)?

Hi, I want to calculate the radial distribution function for water molecules around the Na+ ions adsorbed on the surface of a spherical nanoparticle using the gromacs trajectory dynamically? For...

28 February 2021 5,650 1 View

Langevin Dynamics in shear flow?

Hi, We are trying to simulate particles with Langevin dynamics in a shear flow by Lees-Edwards boundary conditions in MD simulations. It seems thermal forces and shear flow do not go hand in...

23 February 2021 1,761 1 View

How to formulate Energy minimization in Molecular dynamics simulation for alloys using meam potential?

during MD simulation, the atoms are not moving as per required. The problem (as per my observation) lies in energy minimization technique. upon application of tensile strain in x or y direction,...

22 February 2021 380 5 View

How to generate AA6061 alloy or any aluminium alloy crystal in material studio?

I need to carry out molecular dynamics simulation on Aluminium alloy. For this i need the crystal structure that which could be further replicated to form a structure.

22 February 2021 1,410 1 View

How to incorporate Monte Carlo simulation in for a real trading data?

Hello, My area of research is to valuate Exchange option (Margrabe option). I am looking for Monte Carlo simulation technique that can be applied to some real trading data. I have evaluated them...

05 February 2021 1,605 4 View

How, if at all, can R scripts/packages be used to perform cluster analyses and motif analyses on digital trace data?

02 February 2021 728 3 View

How do I analyse a Photoluminescence Spectrum ?

I have a few questions related to PL (images attached for same material by 2 methods), It would be great to get some help. 1. What is the physical meaning of highly intense PL? Does this mean...

02 February 2021 1,791 3 View

How to choose the electrolyte for (electrochemical impedance spectroscopy) EIS ?

Hi, I am working on a multi cationic material that has Li in it. I wish to measure the conductivity of my sample. We have a 3 electrode system with Ag/AgCl as a ref, platinum, and glassy carbon...

29 January 2021 405 2 View

What are the different subclasses in intermediate seeds?

I am currently working on an endemic tree species, that produces mature seeds (moisture content 51%) which shows both vivipary (30% of total harvested seeds from a tree) and dormancy (~40%) of...

20 January 2021 2,670 3 View

How cane capture of Cl, K , Na, in the process of biomass gasification, I want to let these elements enter the solid slag phase but not enter the gas?

I want to fixation Cl, K, Na in gasification slag, which type of catalyst can be used?

13 January 2021 2,145 2 View

What are the countries most affected by extreme rainfall as a result of climate change?

Increased heat, drought and insect outbreaks, all associated to climate change, have increased wildfires. Decreasing water supplies, declined agricultural yields, health impacts in cities owing to...

01 March 2021 7,168 9 View

I have done flood mapping using sentinel 1 image but for validation i am unable to find any dataset...what dataset should i download...??

I have done flood mapping using SAR but for validation i am finding difficulty in getting a data set...i opted for LANDSAT image but there i am facing difficulty in cloud coverage as coverage is...

16 February 2021 4,620 3 View

How do I categories into groups on SPSS?

I am using the 'Revised Cyber Bullying Inventory'. This instrument has 2 sub-scales (bully scale and victim scale). From the responses, they will be divided into 4 groups (pure cyberbullies, pure...

13 February 2021 5,787 4 View

GIS application in flood management?

What is the best GIS approach in flood management?

26 January 2021 419 5 View

Genus name priority from the same publication (Zoology)?

I came across a recent taxonomic work, where two genera were synonymized. Both genera were published in a paper in 1922 by the original author who revised the family at that time. The original...

19 January 2021 1,920 4 View

Do you have some articles to recommend about comparative experimental study about gas and water flooding with oil reservoirs?

I would like to know in the oil extraction, which is more efficient: gas flooding or water flooding? Will water flooding be more efficient in hydrophilic reservoirs with capillary...

29 December 2020 3,471 3 View

Rejected manuscript for journal publish after 1st revision, what needs to be done next?

Hello, My manuscript has been rejected by the editor and reviewers even after the 1st revision. Though I tend to disagree some of the points raised, assume I can't request for another revision...

28 December 2020 6,062 3 View

Manuscript with journal for two years despite six positive reviewer comments due to delays and journal incompetence: How to resolve this?

I am trying to help a friend resolve a problem I have never encountered as an author or as a journal editor. The manuscript was transferred to a journal belonging to Elsevier in December 2018. It...

26 December 2020 9,584 3 View

How to score Hypermasculinity Index-R (Jay Peters, Carey Nason, and Winston M. Turner)?

It's developed by Jay Peters, Carey Nason, and Winston M. Turner as a revised version of Hypermasculinity Index.

24 December 2020 4,450 3 View

Does the corpse of the Covid-19 virus victim still have the potential to transmit this virus?

If there is still potential, how long can this virus still be infected? Please give your comment. Thank you very much. Best regards.

23 December 2020 1,363 8 View