Shaping the future of electronics: nanowires!

Nanowires (NWs) can be defined as cylindrical-shaped nanostructures with diameter in the order of nanometres and that very recently, have been attracting the attention of scientific community due to its unique set of properties which were found to be promising to compose the next generation of nano-electronic devices.

One particular challenge is the synthesis and design of new materials that can be used to manufacture new transistors at the nano-scale, thus revisiting and giving extra-life to the hyper-saturated Moore’s law for electronics and computers processor.  In this context, one-dimensional nanowires have been recently considered the most promising candidates.

However, semiconductor materials are generally produced upon the incorporation of dopants by using ion implantation: a technique that can introduce several different types of defects within the material.

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The IIB phenomenon: (a) a Si NW before irradiation and (b) the same NW during irradiation. Credits Dr. I. Hanif (Sweden).

Our research group led by my french friend O. Camara, has been focusing its attention to the phenomenon of Ion-Induced Bending (IIB) of nanowires and in a recent publication at the Advanced Materials and Interfaces journal, we have demonstrated that  the IIB phenomenon can be mitigated (AND EVEN REVERSED!) by means of Solid-Phase Epitaxial Growth. In order to support the discussion, we have developed a MATLAB-based implementation of the Stopping and Range of Ions on Matter (SRIM) that now is known as IDRAGON: Ion Damage and RAnge in Geometry Of Nanowires. For the whole nanowires community interested in to get a copy of our code, fell free to contact me (m.a.tunes[at]physics.org).

IDRAGON

Atomic displacement profile of nanowire with a diameter of 50 nm obtained with the IDRAGON code.

 

Featured image credits on the top of the post: CVD equipment coorporation.

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Protective coatings on Zr alloys: a pathway towards Accident Tolerant Fuels in Light-Water Reactors technology

The nuclear accident at Fukushima-Daiichi nuclear power complex in 2011 has started a discussion within the nuclear materials community regarding the safety and the operational limits of Zirconium alloys nuclear fuel rods under extreme conditions.

Zirconium is the holy grail of Light-Water Reactors (LWRs) and it is directly responsible for the success of nuclear reactors technology worldwide. Deeply researched by Admiral Hyman G. Rickover and his team in early 1960s [1], this success is mainly attributed to the properties that Zr and its alloys have within the context of a nuclear reactor operation: desirable mechanical properties, good corrosion resistance and low thermal neutron absorption cross section [2-3]. The last topic is of paramount importance as if the nuclear fuel rod material is relatively transparent to thermal neutrons, the efficiency of a nuclear reactor is not penalised (that is the case for stainless steels).

In the Fukushima-Daiichi nuclear power complex, the nuclear reactor lost its coolant material (i.e. water) due to the occurrence of external events: an earthquake and a tsunami [4]. In this operational condition, the temperature inside the nuclear reactor core rose abnormally and the known oxidation reaction between steam and the Zr rods have generated huge quantities of hydrogen gas (H2). The accumulation and leak of H2 was the cause behind several explosions in the nuclear power complex.

Replacing Zirconium in the already consolidated nuclear technology would require the design, test and licensing of a new metallic alloy: a task that would require millions of dollars in investments and in evaluation and tests as well as countless efforts to find a material with similar properties to Zr. One possible solution has been to coating Zirconium alloys with protective materials.

Conventional Titanium Nitride (TiN) and Titanium Aluminium Nitride (TiAlN) thin films are currently some candidate systems [5-6], but recently, the demonstrated feasibility for the synthesis of high-quality nanocrystalline high-entropy alloy thin films has added another perspective regarding protective coatings on Zirconium alloys [7]. Highly-concentrated alloys have been subjected to intense research in the past three years and due to their unique properties and superior resistance to energetic particle irradiation, these alloys are currently looking for some space to be applied in real nuclear systems.

Matt HEATF-Zr

Cross-sectional ion beam image of a high-entropy alloy thin film (B – HEATF) deposited on Zircaloy-4 (A) with a protective Pt layer on top (A). MA Tunes own work.

Clearly coatings on Zirconium alloys will have to exhibit compatibility with the HCP matrix and prove suitable tribological properties. They will also have to cope with the limitations of materials for nuclear structures: reduced activation, good corrosion resistance, improved radiation resistance and desirable mechanical properties. Therefore, these new efforts towards new accident tolerant fuel concepts are just expressing how important the materials research is for our civilisation and how consolidated technologies can always be improved, modified and enhanced upon advances in technology.

References
[1] RICKOVER, Hyman George; GEIGER, Lawton D.; LUSTMAN, Benjamin. History of the development of zirconium alloys for use in nuclear reactors. Energy Research and Development Administration, 1975.
[2] ZAIMOVSKII, A. S. Zirconium alloys in nuclear power. Soviet Atomic Energy, v. 45, n. 6, p. 1165-1168, 1978.
[3] GRIFFITHS, M. A review of microstructure evolution in zirconium alloys during irradiation. Journal of Nuclear Materials, v. 159, p. 190-218, 1988.
[4] HOLT, Mark; CAMPBELL, Richard J.; NIKITIN, Mary Beth. Fukushima nuclear disaster. Congressional Research Service, 2012.
[5] ALAT, Ece et al. Ceramic coating for corrosion (c3) resistance of nuclear fuel cladding. Surface and Coatings Technology, v. 281, p. 133-143, 2015.
[6] ALAT, Ece et al. Multilayer (TiN, TiAlN) ceramic coatings for nuclear fuel cladding. Journal of Nuclear Materials, v. 478, p. 236-244, 2016.
[7] TUNES, Matheus A.; VISHNYAKOV, Vladimir M.; DONNELLY, Stephen E. Synthesis and characterisation of high-entropy alloy thin films as candidates for coating nuclear fuel cladding alloys. Thin Solid Films, v. 649, p. 115-120, 2018.

Do dislocations exist as a real physical entity?

When I was attending in the introductory course in materials science and metallurgy during my master of sciences, one particular question had intrigued myself for long time: are dislocations real physical entities?

As a curious student at the time, during the class, I have respectfully raised my hand and asked the professor: — Do dislocations really exist? And of course, the entire audience started to laugh on me. Students very often have such curiosities inside themselves, but are always reluctant to ask questions thinking they are only stupid doubts.

If you look in a materials science textbook, in most of the cases, the concept of dislocation will be properly described, but the figures often induce the reader/student to think that a dislocation is a real physical entity in the sense that they are something external to the crystal structure and which is added to it somehow. The textbooks sometimes give the impression that the dislocation is something real, something like an artefact.

The physical understanding behind the concept of “dislocation” is from 1930s when the mechanisms of plastic deformation of crystals were under deep investigation in Europe. The Royal Society Yarrow Professor Geoffrey Ingram Taylor was one of the pioneers in this field of research. In his paper entitled: “The Mechanism of Plastic Deformation of Crystals – Part 1 – Theoretical” [1], Taylor defined for the first time what is a dislocation.

Taylor’s early concepts on dislocations were motivated by very interesting experimental observations made by  Joffe et al. [2] in analysing deformed rock salt crystals in nicol prisms (a kind of portable homemade polarized optical microscope). The latter authors noted that in deformed rock salt crystals , a very bright line from side to side of a crystal attracted the attention of that experimentalists whose concluded that such line was a representation of a “crystal breakdown (…) indicating distorted material.”

The theoretical interpretation given by Taylor was made by means of picturing a “crystal block” that under stress, the propagation of a line of slipping atoms within a slip plane would result in a perfectly well ordered crystal structure, but deformed by the unit slip, or the dislocation.

For Taylor a dislocation can be viewed as a kinetic phenomenon of the “passage” of a strain field from side to side of a crystal within a slip plane! This strain field, is of course, caused by the external stresses acting on the crystal. Dislocations do not exist! Dislocation is rather a physical concept that defines a defective region of a crystal structure, not a physical entity.

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The movement of dislocations in recrystallised Au recorded in situ at 1000 K using Bright-Field Transmission Electron Microscopy.

When dislocations are viewed in a transmission electron microscope, they often appear in a form of lines or loops whose are of diffraction contrast, but the contrast is generated because in the analysed region of a dislocation, the crystal structure is defective (it has an extra plane of atoms). Therefore, the contrast does not exhibit something that is external to the crystal lattice itself, but it only shows that there is a defect in the local atomic arrangement which was supposed to be periodic and ordered.

Coming back to my class in the introductory course of materials science and metallurgy, I have asked this question to my professor at the time, he said to me that dislocations were real indeed, but I should be concerned in to study for the tests rather than asking stupid questions.

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Dark-Field Transmission Electron Microscope (DFTEM) micrograph colourised in a computer showing dislocation lines in recrystallised Au at ~ 1000 K

References:

[1] Taylor, Geoffrey Ingram. “The mechanism of plastic deformation of crystals. Part I. Theoretical.” Proceedings of the Royal Society of London. Series A 145.855 (1934): 362-387.

[2] Joffe, Abram Fedorovich, and Leonard Benedict Loeb. “Physics of crystals.” (1928).

 

In order to like mathematics…

… you need a good math teacher!

I was talking to my daughter the other day and she told me how her impression about mathematics improved after she entered the school here in Texas, compared with the school in Brazil. I asked her the reason and she told me that here in the USA the teacher has time to dedicate to the particular needs of the student, while in Brazil the teaching is automatic, rapid and unpersonalized, the teacher explains the subject, to the student remains to understand the subject or simply to skip understanding and focusing in the next subject.

Then I remembered what happened with myself at the school. I was blessed (or cursed) with an analytic mind. An example is the image I chose to illustrate this article. This is the so called Euler’s identity. The first time I saw it (probably at the Physics course) I could not understand why Euler bothered to express it.

If fact its proof is trivial (in my opinion), we have the identity

euler2

where x is read in radians. By simple inspection one observes that the value of this quantity at 180° is real and corresponds to +1, then, for me, the identity was equivalent to stating the 1 – 1 = 0, and if you state this to any person, he or she will say it is obvious. It took me about twenty years to appreciate what is considered an expression of the beauty of mathematics.

At the fundamental school, you will probably find it strange, I initially didn’t like mathematics. The reason, now I recognize, was because I was bored. Teaching mathematics in the fundamental school is a repetition process. Fact is that most persons don’t learn so easily the mechanistic ways of mathematics and this is achieved by solving a lot of identical exercises until this mechanistic process enters the kid’s brain by brute force.

This changed some time in the seventh grade by two fortuitous events.

First, during the winter pause (in Brazil our school winter pause corresponds roughly to the month of July), for some miracle, I decided to take a look at the math textbook to see in advance what would be the subject when the lecture resumed after the pause. I remember it was the solution to quadratic roots (the quadratic formula). I remember it contained a simple deduction (in one page) of the formula (it is the same found in the Wikipedia article), and I read that and understood. I found that marvelous, to understand why a formula was the way it was, and not only to learn the formula. Of course, I went happy to the first mathematics lecture after the pause, to show what I did learn by myself, only for the teacher (an Asian lady, I don’t recall her name) to say she would skip that part because it was unnecessary.

The next fortuitous event was a test for some school Olympiad we had in that year in Sao Paulo. As I told, I was bored with mathematics, as a consequence I rarely did my homework, and, of course, this resulted in bad grades at the tests, in particular I never got a 10 (maximum note) in any math tests ever. I was considered back then an “expert” in Geography. Then this test came, and we had to do it in all subjects, since this would be considered for the school grades. To my surprise, and to the surprise of anybody else in the classroom (and the teachers included) I scored a 10 in that test.

The two events taught me I could like mathematics. I didn’t recognize back then that the reason I disliked math before was because I had very bad teachers, or at least, access to very bad teaching methods. Today I realize this is the reason why so many peoples hate Mathematics. We should have more empathy with our children.

How to write (bad) science fiction

You may find strange that I decided to write an article about science fiction in a Science & Technology Blog. Fact is that, according to my experience, all scientists enjoy science fiction. Granted, not everyone of them like Star Wars or Start Trek, but authors like Phillip K. Dick, Ray Bradbury and Stanislaw Lem are widely appreciated. And, why not, we scientists are also humane, we also need entertainment once in a while.

One of the reasons why science fiction appeals to me is that it allows me to dream. The kind of book allows us to answer the question: What if?

Naturally a good science fiction book (or film)  establishes a set of presumptions about future things, and then the author allow him(her)self to probe what would happen if those presumptions are valid.

Of course, the reality must stretch a bit, if you want to allow interstellar travel, you must somehow overcome the barrier of the speed of light, you must assume there is something like a hyperdrive, or a warp drive, or simply something called FTL (Faster-than-light) engine.

You have to allow people to manipulate the huge amounts of energy required to operate these machines, you may postulate something called dilithium crystals which can safely combine matter and anti-matter (and magically not “fry” everyone around, since a simple event of positron-electron recombination results in two gamma photons with the minimal energy of 0.511 MeV).

I tried already to write some limited science fiction and I know that in order to get your story going forward you have to take some liberties with physics. Even the movie Interstellar, highly appraised for the correct depiction of the relativistic time dilation effects due to the gravity of a black hole overcome the obvious fact that any accretion disk  would produce so much X-ray and gamma radiation which would make the existence of that planet with exposed water unlikely (and forget about the nonsense of entering, and principally, leaving a black hole).

Even though you have to assume some unknown physics to allow your plot to move forward, you have to remain as close as possible to the known physics (and chemistry, and biology) to write good science fiction.

Science fiction allows also some “foretelling”. Authors like Jules Verne or H. G. Wells correctly predicted many of the things we have in our modern world. You don’t need to go so back in time, however, to find science fiction influences you our modern world. It is obvious that our smartphones are a direct adaptation of the communicators in Star Trek (more precisely, they are a crossing between the Tricorder and the communicator). Sometimes science fiction provides us with an idea, which becomes relevant in the future. What to say about the famous prediction by Arthur C. Clarke that in the future all long-range calls would cost the same as a local telephone call? What is the internet, if not the possibility to call someone on the other side of the globe at the price of a local call?

Of course, the predictions do not need to be exact. Since a long time Internet is not related with the telephone line, and any submarine commander would surely laugh at the description of the luxurious interior of the Nautilus (the fiction one). Our smartphones cannot provide data to proceed with a medical diagnosis (yet) and, for sure, they will not work in another planet.

The problem is that in the search for entertainment, some authors end up violating the known laws of physics (and chemistry and biology), therefore producing bad science fiction.

Recently I watched a movie called Cloverfield Paradox. It was advertised as related with the excellent movie Cloverfield, this one really good (and low budget). In particular, the advertisement promised to give some answers about the monster in the first film.

The setting was really interesting, but the film already fails in the premises. We learn right in the beginning of the movie that Earth is facing an energy crisis (obviously caused by the end of our fossil fuel reserves). Anyone with the slightest knowledge of the modern world would ask: “What happened with the solar and wind technologies?”. The worst is that a single line of text in the script could solve this inconsistency, one of the the characters would simply “remind” that these alternative forms of energy are totally dedicated to keeping industries and hospitals working, or that their growth (especially in the case of solar energy) depends of rare raw materials. In my case, the funniest part was watching the characters sitting in a long line before a gas station to get fuel for their cars. It is funny because everyone would ask, why are they using their cars, really? If fuel is so rare, why bother driving around? Are there no mass transport vehicles in the future?

Then we learn that the female protagonist has to go to a space station to operate a particle accelerator which would solve the energy crisis, providing infinite energy. She is referred as vital for the project, and yet, due to careless use of a technology she caused the death of her two kids (this is the vital scientist needed for the project?). We learn that this particle accelerator can only be operated in orbit. OK.

The space stations has even some realistic architecture. A set of rotating rings linked by a tower-like structure. You see that and think, OK, they will provide gravity by inertial forces. The problem is that the characters act like there was real gravity going on. A rotating ring, even if it has a diameter of hundreds of meters, would produce measurable Coriolis forces depending on the height. It would be funny seeing the characters playing with this, for example, throwing a ball to the air and seeing it making a curve, but nobody thought about this (it would be very easy to fake this effect). Another problem related to this is that in no place inside this stations there is absence of gravity (and the characters must migrate between the rings, evidently, using the tower structure, which is not spinning). Would it to be too much to ask for the actors to fake absence of gravity once and a while?

Then they operate (after more than 600 days in space) the so called particle accelerator. Before, obviously, we learn what is the connection with Cloverfield. A conspiracy theorist suggests that operating that particle accelerator could open portals to another dimension allowing monsters to invade Earth. Really? Why? How does the guy knows this? (obviously, he read the script for Cloverfield).

The operation obviously goes awkward, and suddenly, Earth is no longer where it was. Whaaat? Even thought the connection with other dimensions and other universes, how could you justify the disappearance of an entire planet? With the progress of the story we discover that this happened because a fancy gyroscope went missing. Really, one gyroscope? A space station like that would have lots of gyroscopes (not to mention that the rotating rings are some sort of gyroscope themselves).

There are other inconsistencies like these, in one scene the rotating rings are in attrition with the structure and they produce sparks. I think nobody told them that oxygen is necessary to produce sparks.

When I was at the Physics course, in the 1980’s, the most interesting book at that time was the first Portuguese translation of A brief history of time, by Stephen Hawking. Not because of the content, but because the translation was so full of errors, that the the fun was to try to understand what the English version told, based on the faulty translation. At that time one of my professors told that the publisher contacted a physicist in Rio de Janeiro to do this translation, and the guy asked for some payment to do this, the publisher was not satisfied with this, and, obviously, hired an English-literature student to do this (obviously, but much less money). My feeling with Cloverfield Paradox is this, they decided not to hire the physics professor to be consultant. A pity is that the general plot is actually good (if you disregard this bullshit of parallel universes), but these inconsistencies destroy the film (or, maybe you want to watch the film to spot these inconsistencies, as my colleagues in Brazil did with the book).

To end, just about the last scene of the film. The main female protagonist is finally returning to Earth, fleeing a crumbling and disintegrating space station, besides her only one colleague, hurt, survived (the others died with horrible deaths, I will not talk about the complete violation of the second law of thermodynamics in the middle of the film), and the mission control manages to call her husband on Earth to tell the good news. The reaction of the guy is to say, “tell them not to come”! Really? What does he expect them to do? It is better to die in the cold of the space or burned in the uncontrolled reentry of the wreck of the space station? And finally, the monster appears.

 

 

 

 

 

Michael Marder’s Fracking Physics

Yesterday I was able to attend the seminar given by Michael Marder (UT Austin) about “hydrofracture as a materials problem” at the Materials Science and Engineering Department of the Texas A&M University. I didn’t know Prof. Marder, but learned he is author of a popular textbook on condensed matter physics.

It was a pleasure hearing him, he showed complete control of the audience, in the majority composed of graduate students. He started by telling how he got involved with the theme, and clearly stating what were the science difficulties involved in the research. These were the necessity to bridge wide gaps in scale (processes taking place in the nanometer scale for structures hundred of kilometers wide) and the highly interdisciplinary character of the subject.

Hydrofracture is the official name of the the activity popularly called “fracking”: the extraction of hydrocarbon gases impregnated in shale rock (in Portuguese, shale in known as “Xisto betuminoso”). This extraction is difficult, because the medium is impermeable. Another source of difficulty is the distribution of the rock, which is very wide in area, but very thin in thickness.

The solution to this problem is the application of high pressure fluids to opened wells, which fracture the rock, releasing the entrapped gas. The talk was centered in the modeling of this fracture process and gas extraction and the achievements were really impressive.

The interesting aspect of his talk, however, were the economic driven parts of his talk. First he showed that shale gas played a prominent role in adverting the worst effects of the 2008 economic crisis in the USA, by decreasing the energy costs. Second, the own results show that the activity will be short -lived. The estimate is that the shale gas extraction has the potential to deliver energy for 30 year, but not much more, therefore Prof. Marder defends, as it is the opinion of the present author too, that all energy sources must be researched and developed.

_65309507_shale_gas_extraction464.gif

 

 

The physical chemistry of brewing a decent coffee

I am brazilian, therefore I am addicted to coffee. OK, not all brazilians drink coffee, as not all US Americans play baseball. This does not change the fact that I feel miserable if I have to go out my home in the morning without drinking a large mug of the dark brew (which I drink without additions, including sugar).

I also travel a lot, occasionaly going to places in which coffee is decisively horrible. Recently a former student went through the same problem, and this reminded me of the period in which I lived in Germany.

Not that German coffee is that bad, at least there are places in the world in which coffee is even worse. The problem with German coffee is that if you drink it using a glass, you can see through! For me, this was something like an heresy.

Being myself a scientist, I decided to make experiments. Soon I discovered that the amount of powder didn’t matter. Neither did the roasting level. I tried powders of various provenances, but this didn’t help either. 

Then, one day, I was buying coffee powder at a specialized shop called Tschibo (I had already partially solved my problem, noticing that freshly ground coffee produced better results) when the vendor asked me wether I wanted my powder fein  gemahlen (finely ground) or grob gemahlen (coarsely ground). I asked her what was the difference and she explained to me that the finely ground particles were designed for expresso machines and that if I used it with normal filter, I would get particles going through.

Imediately I realized the solution to my problem, I asked my powder finely ground and confirmed the next day that I was able to brew Brazilian  quality coffee in Germany.

My explanation is the following: in Brazil the griding machines are old, the filters are bad, so many fine particles pass, giving the excellent taste we are used to. In Germany the machines are brand new, the filters are perfect, and hence, only liquid passes. Naturally, having solid particles in suspension the Brazilian coffee becomes opaque.

Of course, according to the scientific method, I would need to further test my hypothesis. I would need to perform a granulometric analysis of the different powders, or verify the solid residues left from evaporation. As my good friend, Eng. Alberto Imoto thaught me, however, in the case of performance-driven research you are entitled to stop the action once you get the desired effect.