Can anyone refer me to any relevant articles regarding this?
Hi, I am working on LAMMPS molecular simulation on CO2 mineralization. I have some scripts which require to compile Lammps files using cmake in ubuntu. Is there anyone who has some expertise can...
20 May 2024 5,026 2 View
Recently I am doing my undergrad thesis on CuO thin film. I am facing problem in XRD characterisation as the peak in 32 degree becomes abnormally high whereas it should be a minor peak. What could...
02 February 2023 1,039 5 View
I want to do MD simulation with LAMMPS on calcite, magnesite, silica and other mineral to figure out their minerals. But, firstly I need to create data file that contains coordinates, bond,...
12 June 2022 9,374 1 View
I want to know how to run an MD simulation on a metal or substance for getting to know about its stress, strength energy, deformation, etc. for doing research on it.
31 March 2022 3,488 4 View
I wish to learn Python codes programming in Peng-Robinson equation or SRK equation to know the z-factors or other thermodynamic properties for any kinds of mixtures.
29 March 2022 2,471 3 View
Molecular Dynamic (MD) simulation for fluid-fluid or fluid-rock interaction process is not a new thing though, but only few have thought about this in case of mineral processing. I want to work...
07 February 2022 3,159 1 View
Actually, i need this information as soon as possible for my undergraduate thesis entitled in " Influence of moisture content on coal deformation model during CBM production in wet reservoirs ". I...
04 October 2019 4,064 1 View
I have a protein that have degradation porducts after rounds of purification. I have tried Affinity-Ion Excahange-Gel filtration but they are not able to separate the degraded products from the...
24 January 2010 3,266 3 View
Greetings When one is to perform Simulation or modelling of Pyrolysis of Biomass Waste materials using Aspen Plus software, and one has both the macromolecules breakdown (Cellulose, Lignin and...
06 August 2024 5,023 1 View
Hello. I am working on ROS production of two systems: system A is cerium oxide and hydrogen peroxide, system B is cerium oxide nanoparticle, hydrogen peroxide and potassium bromide. I did some...
04 August 2024 5,974 3 View
Why BaO (s) + H2O(l) ---> Ba 2+(aq) + 2 OH - (aq) if Oxygen loves owning all the electrons, why would it bind to hydrogen which competes with Oxygen for electron ownership more so than...
03 August 2024 5,392 1 View
I imagine the battery drives the graphite into a carbocation, then chloride is oxidized to donate the electron to the carbocation, but what pushes the lost electrons of chloride to be shared...
03 August 2024 5,384 0 View
I heard an explanation about something being a better proton acceptor or lone pair donor but that doesn't make sense. I couldn't explain in in terms of acid-base theory. The hand-waving way I saw...
03 August 2024 9,918 0 View
How to calculate the molar proportions of the oxides from the XRF analyses?
02 August 2024 2,565 2 View
for eg. transition shock scale
01 August 2024 5,998 0 View
Dear all! Oxygen vacancies do raise negatively the Fermi level by increasing the negative charge in the semiconductor crystal structure. In the case of n-type semiconductors, I wonder if this...
30 July 2024 8,339 2 View
Hello, colleagues. Recently, I have been working on a metal processing simulation with my UMAT in Abaqus. I have outlined the corresponding simulation, but I keep encountering issues that cause...
30 July 2024 7,062 1 View
Hello Everyone! I am trying to create a metal hydride system where I am trying to create a temperature control with the emphasis on measuring the concentration of the hydrogen with the hydrogen...
29 July 2024 7,577 2 View
