Questions tagged [physical-properties-of-materials]

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2
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0answers
18 views

Rule of Mixtures calculation

I do not understand a part from rule of mixtures.Particularly between upper bound elastic modulus and lower bound elastic modulus calculations I seriously do not understand what value to choose based ...
12
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1answer
72 views

What are the physical consequences of adding a constant to the diagonal of the effective Hamiltonian of monolayer materials?

Effective Hamiltonians modeling many-layered materials are often tuned using some sort of bias voltage. For instance, in a $4\times 4$ Hamiltonian matrix to describe biased bilayer graphene using some ...
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0answers
33 views

How to judge the character and sign of a dislocation?

I do understand that $ \mathbf b||\mathbf t$ for screw dislocation but I am unable to judge the sign of the dislocation. Again if $\mathbf b \perp \mathbf t$ how do I judge its sign? Any formula which ...
7
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1answer
54 views

Where is this extra plane coming from?

Why are there solid lines drawn connecting the solid circles after twinning has taken place? Ideally, that explains a real plane, isn't it? But why are we going to get a plane out of nothing if we ...
5
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1answer
94 views

Why does twinning take place in high rate of shock loading and low temperature?

To quote from a good textbook, which I don't remember: "Twins which are produced by mechanical deformation are called mechanical twins. Mechanical twins are produced in bcc or hcp metals under ...
6
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1answer
93 views

Can replacing some of the atoms in a covalent network with that of the element one atomic number higher make it nonstick? [closed]

I originally made the title the question I had that is a more suitable question but then it ended up too long. I had the idea that if you replace some of the atoms in a covalent network with the atom ...
6
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0answers
33 views

What is strain/loading rate dependence/sensitivity of compressive strength of brittle materials?

What is the definition of strain/loading rate dependence/sensitivity of compressive strength of brittle materials? Is it general strain/loading or it is specific for the brittle materials?
4
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0answers
29 views

What types of materials can be tested in a split Hopkinson pressure bar?

A split Hopkinson pressure bar can test different types of specimens, I would like to know what types of materials that are suitable to be tested with this method?
8
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1answer
54 views

What are the possible applications of DIC (digital image correlation) in mechanical testing and the field of materials science?

I would like to know about possible applications of DIC in mechanical testing and the field of materials science, when I search there is the general topics of DIC usages, but I would like to know ...
13
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1answer
115 views

Has a form of diamond with certain properties ever been theorized?

The following is what a Penrose tiling looks like: I know the verticies of a dodecahedron can be grouped into 5 groups each of which are the verticies of a tetrahedron. So I thought of the idea that ...
10
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2answers
223 views

Why are my publications getting accepted without much review from some journals, but getting rejected by the journal Computational Materials Science?

My field of research is computational materials science/mechanics. My work is on the "numerical modeling of shot peening process". This is a typical publication in my field. My work is not ...
12
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1answer
77 views

Calculating hyperpolarizability in NWChem

I'm trying to make a pipeline geometry optimization -> calculation of polarizability/hyperpolarizability. And NWChem seems pretty good for it, the only thing I can't understand its how to calculate ...
7
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1answer
53 views

How to understand effect of increase in band gap generated away from Fermi energy on conductivity?

An example would be that when we dope Nitrogen in graphene its conductivity decreases. This can be explained through other means. But can this be explained through the change in its band structure?
7
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32 views

How can one computationally determine the flammability of a molecular system?

I can imagine one aspect of flammability (the ability of a substance to ignite on fire) to include calculating the kinetics and thermodynamics of the reaction of the system with oxygen. This is not ...
10
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0answers
43 views

A viscoelastic material with nonconvex memory kernel?

The title is basically my question. Viscoelastic materials are characterized by a constitutive equation between stress and strain involving a convolution integral. This integral is weighted with a ...
4
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2answers
97 views

Is there a material where the conductivity drops when the current increases?

I would like to know if anyone knows of a material where the conductivity drops when the current increases? Usually, it's the opposite.
10
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0answers
73 views

How can I draw the energy bands for the first and second zones of Brillouin? Is it conductor or insulator?

I want to draw the energy ($E$) diagrams for a simple cubic cell of parameter $a$, where each atom provides two electrons for the almost free electron levels for planes [100], [110] and [111]. I ...