The extraordinary properties of Graphene are well known, and in the context of electronics thermal management and reliability, it is about 200 times stronger than the strongest steel and conducts heat and electricity very efficiently. Both graphene and carbon nanotubes consist of six-atom rings, which create the well-known hexagonal Honeycomb structure, and both excel at the rapid transfer of electricity and phonons.
But when a nanotube grows from graphene, atoms facilitate the turn by forming heptagonal (seven-member) rings instead. Scientists have determined that forests of nanotubes grown from graphene are excellent for storing hydrogen for energy applications, but in electronics, the heptagons scatter phonons and hinder the escape of heat through the pillars.
Now a team of Rice University Physicists led by Boris Yakobson have found that putting a cone-like “chimney” between the graphene and nanotube all but eliminates a barrier that blocks heat from escaping. Published recently in the American Chemical Society’s Journal of Physical Chemistry C, the paper “Nanochimneys: Topology and Thermal Conductance of 3D Nanotube–Graphene Cone Junctions” provides more information on the pillared 3D carbon architectures and the structures of the nanochimneys.
The researchers at Rice discovered through computer simulations that by selectively removing atoms from the two-dimensional graphene base would force a cone to form between the graphene and the nanotube. The topology of the graphene-to-cone and cone-to-nanotube transitions require the same total number of heptagons, but they are more sparsely spaced and leave a clear path of hexagons available for heat to race up the chimney.
“Our interest in advancing new applications for low-dimensional carbon — fullerenes, nanotubes and graphene — is broad,” Yakobson said. “One way is to use them as building blocks to fill three-dimensional spaces with different designs, creating anisotropic, nonuniform scaffolds with properties that none of the current bulk materials have. In this case, we studied a combination of nanotubes and graphene, connected by cones, motivated by seeing such shapes obtained in our colleagues’ experimental labs.”
The researchers tested phonon conduction through simulations of free-standing nanotubes, pillared graphene and nano-chimneys with a cone radius of either 20 or 40 angstroms. The pillared graphene was 20 percent less conductive than plain nanotubes. The 20-angstrom nano-chimneys were just as conductive as plain nanotubes, while 40-angstrom cones were 20 percent better than the nanotubes.
“The tunability of such structures is virtually limitless, stemming from the vast combinatorial possibilities of arranging the elementary modules,” said Alex Kutana, a Rice research scientist and co-author of the study. “The actual challenge is to find the most useful structures given a vast number of possibilities and then make them in the lab reliably.
“In the present case, the fine-tuning parameters could be cone shapes and radii, nanotube spacing, lengths and diameters. Interestingly, the nano-chimneys also act like thermal diodes, with heat flowing faster in one direction than the other,” he said.
Rice graduate student Ziang Zhang is lead author of the paper. Ajit Roy, a principal materials research engineer at the Air Force Research Laboratory in Dayton, Ohio, is a co-author. Yakobson is the Karl F. Hasselmann Professor of Materials Science and NanoEngineering and a professor of chemistry.
The Air Force Office of Scientific Research and its Multidisciplinary University Research Initiative supported the research. Calculations were performed on Rice’s National Science Foundation-supported DAVinCI supercomputer administered by the Center for Research Computing, procured in partnership with the Ken Kennedy Institute for Information Technology.
Source: Rice University
