Nanoporous graphene could outperform best commercial water desalination techniques

June 22, 2012 by Lisa Zyga feature
(Top left) Hydrogenated and (top right) hydroxylated graphene pores. (Bottom) Side view of the simulated nanoporous graphene filtering salt ions and producing potable water. Image credit: Cohen-Tanugi and Grossman. ©2012 American Chemical Society

( -- Although oceans and seas contain about 97% of Earth’s water, currently only a fraction of a percent of the world’s potable water supply comes from desalinated salt water. In order to increase our use of salt water, desalination techniques must become more energy-efficient and less expensive to be sustainable. In a new study, two materials scientists from MIT have shown in simulations that nanoporous graphene can filter salt from water at a rate that is 2-3 orders of magnitude faster than today’s best commercial desalination technology, reverse osmosis (RO). The researchers predict that graphene’s superior water permeability could lead to desalination techniques that require less energy and use smaller modules than RO technology, at a cost that will depend on future improvements in graphene fabrication methods.

The scientists, David Cohen-Tanugi and Jeffrey C. Grossman of MIT, have published their study on using single-layer nanoporous graphene in a recent issue of Nano Letters.

“This work shows that some of the drawbacks of current desalination techniques could be avoided by inventing more efficient and targeted membrane materials,” Grossman told “In particular, tailored nanostructuring of membranes could allow for actual flow of water (with full salt rejection) via size exclusion, leading to much higher permeability compared to reverse osmosis.”

This is not the first time that researchers have investigated the use of nanoporous materials for desalination. In contrast to RO, which uses high pressure to slowly push water molecules (but not salt ions) through a porous membrane, nanoporous materials work under lower pressures and provide well-defined channels that can filter salt water at a faster rate than RO membranes.

When water molecules (red and white) and sodium and chlorine ions (green and purple) in saltwater, on the right, encounter a sheet of graphene (pale blue, center) perforated by holes of the right size, the water passes through (left side), but the sodium and chlorine of the salt are blocked. Graphic: David Cohen-Tanugi

However, this is the first time that scientists have explored the potential role of nanoporous graphene as a filter for water desalination. Single-layer graphene, which is just one carbon atom thick, is the ultimate thin membrane, making it advantageous for water desalination since water flux across a membrane scales inversely with the membrane’s thickness.

Using classical molecular dynamics simulations, Cohen-Tanugi and Grossman examined the water permeability of nanoporous graphene with different pore diameters (1.5 to 62 Å2) and pore chemistry. As previous experiments have demonstrated, nanopores can be introduced in graphene by a variety of methods, including helium ion beam drilling and chemical etching. In their simulations, the scientists strengthened the nanopores by passivating, or shielding, each carbon atom at the pore edge with either hydrogen atoms or hydroxyl groups.

Water permeability of various desalination techniques. The graphene nanopores can reject salt ions with a water permeability 2-3 orders of magnitude higher than commercial reverse osmosis (RO) techniques. Image credit: Cohen-Tanugi and Grossman. ©2012 American Chemical Society

“Because those carbon atoms at the pore edge would be quite reactive without passivation, in one way or another under realistic experimental conditions they will likely have some form of chemical functionalization,” Grossman said. “This can be controlled to some extent, so we wanted to explore the two limits of hydrophobic vs. hydrophilic edge chemistries. If we had no functional groups (just bare carbon) then within a short time water molecules would dissociate at the pore edge and likely either hydrogenate or hydroxylate those carbons.”

The scientists compared the two chemistries, along with different pore sizes, of nanoporous graphene in their simulations by running saltwater with a salinity of 72 g/L over the membranes, which is about twice the salinity of average seawater (about 35 g/L).

They found that, although the largest nanopores could filter water at the highest rate, large nanopores allowed some salt ions to pass through. The simulations identified an intermediate range of nanopore diameters where the nanopores were large enough to allow the passage of water molecules but small enough to restrict salt ions.

The simulations also showed that the hydroxylated graphene significantly enhances the water permeability, which the scientists attribute to the hydrophilic nature of the hydroxyl groups. Since, in contrast, the hydrogenated pores are hydrophobic, water molecules can flow through only when in a limited number of highly ordered configurations. But hydrophilic groups allow to have a greater number of hydrogen-bonding configurations inside the pores, and this lack of restrictions increases the water flux.

Overall, the results show that nanoporous graphene can theoretically outperform RO membranes in terms of water permeability, which is expressed in liters of output per square centimeter of membrane per day and per unit of applied pressure. Whereas high-flux RO has a water permeability of a few tenths, the simulations showed that nanoporous graphene’s permeability ranged from 39 to 66 for pore configurations that exhibited full salt rejection (23.1 Å2 hydrogenated pores and 16.3 Å2 hydroxylated pores). Graphene with the largest hydroxylated pores reached 129, but allowed some passage of salt ions.

The scientists explain that there are two main challenges facing the use of nanoporous graphene for desalination purposes. One is achieving a narrow pore size distribution, although rapid experimental progress in synthesizing highly ordered porous suggests that this may soon be feasible. The other challenge is mechanical stability under applied pressure, which could be achieved using a thin-film support layer such as that used in RO materials.

“Computationally, we're looking at a range of other potentially new ways to engineer membranes for desalination and decontamination,” Grossman said. “Experimentally, we are currently fabricating nanoporous membranes and hope to test their desalination performance in the coming months.”

Explore further: From seawater to freshwater with a nanotechnology filter

More information: David Cohen-Tanugi and Jeffrey C. Grossman. “Water Desalination across Nanoporous Graphene.” Nano Letters. DOI: 10.1021/nl3012853

Journal reference: Nano Letters search and more info website


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5 / 5 (1) Jun 22, 2012
2.8 / 5 (8) Jun 22, 2012
effective water desalinization is hands down going to be the biggest breakthrough in the world if and when it happens.

it' definitely the key to many many issues. from water, comes food, comes life.
2.3 / 5 (3) Jun 22, 2012
If this is made, then humanity can only benefit.

I notice the vote thus far stands six votes made, all for max stars. That's good, overall: now if only policy makers would stop politicizing everything.
4.3 / 5 (6) Jun 22, 2012
We really need the ability to produce graphene on large scales. That should have top priority right now. With all the simulations and experimental evidence as to its uses that would radically change so many fields.
2.5 / 5 (8) Jun 22, 2012
We really need the ability to produce graphene on large scales. That should have top priority right now. With all the simulations and experimental evidence as to its uses that would radically change so many fields.

And, it would provide a ready market for reclaimed industrial carbon, providing a further market incentive for carbon capture technology installation.

And since "ought to" -even for the continued survival of life on earth as we know it- clearly isn't sufficient reason for widespread adoption of the technology, the most likely way to get the job done is to create a market-based demand for the resource.

Then the slobbering freemarketeers will be falling all over themselves to be the first on their block to get it up and running.

Green isn't good enough until it is green(back$$$).

5 / 5 (2) Jun 22, 2012
We really need the ability to produce graphene on large scales. That should have top priority right now.

You can almost guarantee its a priority some where to get that to happen.
1 / 5 (7) Jun 22, 2012
Graphene and computational material science FTW!
2.6 / 5 (5) Jun 22, 2012
We really need the ability to produce graphene on large scales. That should have top priority right now.

You can almost guarantee its a priority some where to get that to happen.


Yeah -kind of. The thing that is holding back large-scale production of these very useful carbon compounds is a recognized market for them.

As it stands now, no one knows for sure which application to build for. Sheets of graphene for solar? Chip sets?
Nanotubes for filtration or waveguides? Buckyballs for?

It's all about application, and nothing has emerged, to date, to serve as a launching place for any of this carbon-based technology- they are all still pretty much in the R&D/prototyping stage of development.
5 / 5 (2) Jun 22, 2012
They still have to engineer large scale graphene sheets so we will have to wait for that breakthrough as well. Then things will start rolling.
2.3 / 5 (3) Jun 22, 2012
There is a story making the rounds in the science related popular press about how a new method of making graphene more cheaply and easily for labs. I don't know how well it will scale up for industrial use but it sounds promising.

There are also some other techniques being investigated, some of which might work synergistically with these filters. It may come to pass that one method is better for reducing salt content with another being more practical at getting to pure water from water with lower salt content than full sea water. Then we could put them together in a two step process.
5 / 5 (3) Jun 22, 2012
What is the absolute minimum amount of energy needed to separate salt from water?
not rated yet Jun 22, 2012
Since they need a substrate to support the graphene sheets in this and other applications, I'm guessing the way to get large sheets will be come up with a substrate that causes the graphene to self-organize on its surface. Put holes in it of the right size and in the right places, get the pores you want in your graphene. (See also that article the day before this one about tunable quantum dots from graphene "drumheads" on a silicon substrate.)
5 / 5 (1) Jun 22, 2012
The problem is that a substrate that would be perfect would also have a hexagonal shape and have the same distance between atoms as graphene.
And the only substance that does that is... graphene.
Anything else will either have a larger distances (silicon crystals or boron sheets) or will just not give you the hexagonal structure to grow on. Any way you do it you get stresses which destroy the regular structure.

There may be a way with a multilayer subtsrate where the second layer down alters the surface properties enough to get a good substrate by evening out the stress. But that has yet to be constucted.

Anyhow - epitaxial growth is too slow (and costly). A roll-on process would be preferrable.
4.3 / 5 (7) Jun 23, 2012
Efficient desalinization, hydrogen fusion, and relatively high-temperature superconductivity would in combination make a world that would be hard to recognize. I hope we see them all in my lifetime..
2.5 / 5 (2) Jun 23, 2012
Efficient desalinization, hydrogen fusion, and relatively high-temperature superconductivity would in combination make a world that would be hard to recognize. I hope we see them all in my lifetime..

I think we will only see the first one in our time.
not rated yet Jun 23, 2012
What is wrong with a three layers of graphene at very low pressure?
1 / 5 (1) Jun 23, 2012
The holes may not overlap at the case of multiple layers.
What is the absolute minimum amount of energy needed to separate salt from water
Their hydration energy and Gibbs free energy of mixing.
1 / 5 (2) Jun 23, 2012
It seems that there may also be a use for this in the sewage treatment plants to assist with final filtering of heavy metals and other sub-microscopic particles.
5 / 5 (2) Jun 23, 2012
Would it help allow us to use sea water and filter it into drinking water? Because even in the Uk we have hose pipe bans, if we could use sea water with cheap ways of filtering the water it would be end the issue of low rain levels we some times get... ?

And if it is cheap - it can also help the v.poor countries in Africa too.
not rated yet Jun 24, 2012
What is the absolute minimum amount of energy needed to separate salt from water?

I'm partial to the way the earth has been doing it for a long time. Evaporation and condensation. Any coastal area with sufficient thermal energy from the sun could produce a significant amount of potable water. The brine could be pumped a good way back out to sea with some kept for salt production.
not rated yet Jul 03, 2012
whats wrong with salt in some applications? soft water and plants to name a few...
not rated yet Jul 03, 2012
Sure, you can have some salt in a few applications, but most of civilization's potable water needs require the salt be removed.
1 / 5 (2) Aug 08, 2012
The big problem with seawater RO systems - besides the high energy inputs are the per-filtering and harsh chemical back-washes needed to maintain the membranes. A carbon based "membrane" is likely going to be even worse from a maintenance stand point. I note no discussion on maintenance differences and costs - which normally means all of this is still at the early conceptual stage of R&D.
not rated yet Aug 09, 2012
No matter what the fresh water source wells,springs,rivers,it will be tested and cleaned.This takes maintenance costs.Many golf courses have partial recovery systems for their irrigation needs,and more work should be done to make this method cheaper for larger farms.
We need not begin arguing about this problem of water shortage,the medical costs of having substandard water makes this a moot point.

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