An Investigation into the Performance and Mechanisms of Soymilk-Sized Handmade Xuan Paper at Different Concentrations of Soymilk.

Invaluable paper relics that embody a rich traditional culture have suffered damage, requiring urgent restoration. In this context, the utilization of soymilk as a sizing agent holds great significance and reverence. This study investigates the use of soymilk as a sizing agent for Xuan paper and evaluates its effects on various properties and the long-term behavior of the paper. The findings reveal that the application of soymilk as a sizing agent for Xuan paper imparts distinct properties, including hydrophobicity, improved mechanical properties, and unique chromaticity. These characteristics-arising from the papillae on the surface of the Xuan paper, the protein folding of the soy protein, and hydrogen-bonding interactions between the soy protein and paper fibers-play a crucial role in shaping the paper's unique attributes. From a physicochemical perspective, the aging process leads to multiple changes in paper properties. These changes include acidification, which refers to a decrease in pH, as well as a decline in mechanical strength, an increase in chromaticity, and a decrease in the degree of polymerization (DP) of the paper. The Ekenstam equation is employed to predict the lifespan of the paper, showing longer lifespans for Sheng Xuan paper and a negative correlation between soymilk concentration and lifespan in soymilk-sized paper. Our work provides valuable insights for the preservation and maintenance of paper, highlighting the potential benefits and challenges of using soymilk for surface sizing.

Nanostructure engineering of two-dimensional diamonds toward high thermal conductivity and approaching zero Poisson's ratio.

Two-dimensional diamond, also called diamane, has attracted great research attention for its novel physical properties and potential applications in nanoelectronics, ultrasensitive resonators and thermal management. Compared with the hexagonal diamane, the physical properties of the rectangular diamane are less explored. In this work, using first-principles calculations, we conducted a comprehensive study on the electronic, phononic, thermal and mechanical properties of three types of rectangular diamanes. We found that rectangular diamanes possess a high Debye temperature (722-788 K) and a strong in-plane Young's modulus (405.9-575.9 N m-1). We further show close to zero Poisson's ratio in the rectangular Pmma diamane. Moreover, based on the phonon Boltzmann transport equation, high room temperature lattice thermal conductivity (910-1807 W m-1 K-1) and strong configuration and orientation dependence are demonstrated. Phonon group velocity, relaxation time and characteristic square velocity are explored and it is demonstrated that phonon harmonic behavior is responsible for the remarkable configuration dependent thermal conductivity in rectangular diamanes. The present work underscores the use of nanostructure engineering to manipulate thermal conductivity of 2D diamond, which provides opportunities for developing effective thermal channeling devices.

Remarkable decrease in lattice thermal conductivity of transition metals borides TiB2by dimensional reduction.

Two-dimensional transition metals borides TixBxhave excellent magnetic and electronic properties and great potential in metal-ion batteries and energy storage. The thermal management is important for the safety and stability in these applications. We investigated the lattice dynamical and thermal transport properties of bulk-TiB2and its two-dimensional (2D) counterparts based on density functional theory combined with solving phonon Boltzmann transport equation. The Poisson's ratio of bulk-TiB2is positive while it changes to negative for monolayer TiB2. We found that dimension reduction can cause the room-temperature in-plane lattice thermal conductivity decrease, which is opposite the trend of MoS2, MoSe2, WSe2and SnSe. Additionally, the room temperature thermal conductivity of mono-TiB2is only one sixth of that for bulk-TiB2. It is attributed to the higher Debye temperature and stronger bonding stiffness in bulk-TiB2. The bulk-TiB2has higher phonon group velocity and weaker anharmonic effect comparing with its 2D counterparts. On the other hand, the room temperature lattice thermal conductivity of mono-Ti2B2is two times higher than that of mono-TiB2, which is due to three-phonon selection rule caused by the horizontal mirror symmetry.

Three-Fold Enhancement of In-Plane Thermal Conductivity of Borophene through Metallic Atom Intercalation.

We studied the thermal conductivity of Al-intercalated bilayer δ4 borophene sheet by solving phonon Boltzmann transport equation based on density functional theory. Although the overall atomic density of Al-intercalated borophene is larger than that of δ4 borophene, it possesses significant enhancement in in-plane thermal conductivity. With metallic atom intercalation, the armchair-direction thermal conductivity increases from 53.8 to 160.2 W m-1 K-1 and that along the zigzag direction increases from 115.7 to 157.2 W m-1 K-1. This pronounced enhancement is attributed to the bunching of the acoustic branches in the Al-intercalated borophene, which decreases the phase space for the high frequency three acoustic phonon scattering processes. In addition to the pronounced increased thermal conductivity, the Al-intercalation also tunes the in-plane anisotropy. This study illustrates the importance of metallic atom intercalation in the in-plane thermal conductivity of 2D van der Waals materials and also has practical implications for fields ranging from thermal management to thermoelectrics design.

The important role of strain on phonon hydrodynamics in diamond-like bi-layer graphene.

In this work, combining first-principles calculation and the phonon Boltzmann transport equation, we explored the diffusive thermal conductivity of diamond-like bi-layer graphene. The converged iterative solution provides high room temperature thermal conductivity of 2034 W mK-1, significantly higher than other 2D materials. More interesting, the thermal conductivity calculated by relaxation time approximation is about 33% underestimated, revealing a remarkable phonon hydrodynamic transport characteristic. Significant strain dependence is reported, for example, under 5% tensile strain, room temperature thermal conductivity (1081 W mK-1) of only about 50% of the strain-free sample, and under 20% strain, it reduces dramatically to only about 11% of the intrinsic one (226 W mK-1). Unexpectedly, in addition to the remarkable reduction in the absolute value of thermal conductivity, tensile strain can impact the hydrodynamic significance. For example, under 5% strain, the underestimation of relaxation time approximation in thermal conductivity is reduced to 20%. Furthermore, using a non-equilibrium Green's function calculation, high ballistic thermal conductance (2.95 GW m-2 K-1) is demonstrated, and the mean free path is predicted to be 700 nm at room temperature. The importance of the knowledge of phonon transport in diamond-like bi-layer graphene goes beyond fundamental physics owing to its relevance to thermal management applications due to the super-high thermal conduction.

Phonon stability and phonon transport of graphene-like borophene.

Recent decades have seen tremendous progress in quantitative understanding of phonon transport, which is critical for the thermal management of various functional devices and the proper optimization of thermoelectric materials. In this work, using a first-principles based calculation combined with the non-equilibrium Green's function and a phonon Boltzmann transport equation, we provide a systematic study of the phonon stability and phonon transport of a monolayer boron sheet with a honeycomb, graphene-like structure (graphene-like borophene) in both ballistic and diffusive regimes. For free-standing graphene-like borophene, phonon instabilities occur near the centre of the Brillouin zone, implying elastic instability. Investigation of the electronic structures shows that the phonon instability is due to the deficiency of electrons. Our first-principles results show that with net charge doping and in-plane tensile strain, graphene-like borophene becomes thermodynamically stable in ideal planar nature, because the bonding characteristic is modified. At room temperature, the ballistic thermal conductance of graphene-like borophene (7.14 nWK-1 nm-2) is higher than that of graphene (4.1 nWK-1 nm-2), due to high phonon transmission. However, its diffusive thermal conductivity is two orders of magnitude lower than graphene, because the phonon relaxation time is dramatically reduced compared with its carbon counterpart. Although the phonon group velocity and phonon anharmonicity are comparable with those of graphene, the suppressed phonon space results in dramatically strong phonon-phonon scattering. These thermal transport characteristics in both ballistic and diffusive regimes are of fundamental and technological relevance and provide guidance for applications of boron-based nanomaterials in which thermal conduction is the major concern.

High thermal conductivity driven by the unusual phonon relaxation time platform in 2D monolayer boron arsenide.

The cubic boron arsenide (BAs) crystal has received extensive research attention because of its ultra-high thermal conductivity comparable to that of diamond. In this work, we performed a comprehensive study on the diffusive thermal properties of its two-dimensional (2D) counterpart, the monolayer honeycomb BAs (h-BAs), through solving the phonon Boltzmann transport equation combined with first-principles calculation. We found that unlike the pronounced contribution from out-of-plane acoustic phonons (ZA) in graphene, the high thermal conductivity (181 W m-1 K-1 at 300 K) of h-BAs is mainly contributed by in-plane phonon modes, instead of the ZA mode. This result is explained by the unique frequency-independent 'platform' region in the relaxation time of in-plane phonons. Moreover, we conducted a comparative study of thermal conductivity between 2D h-BAs and h-GaN, because both of them have a similar mass density. The thermal conductivity of h-BAs is one order of magnitude higher than that of h-GaN (16 W m-1 K-1), which is governed by the different phonon scattering process attributed to the opposite wavevector dependence in out-of-plane optical phonons. Our findings provide new insight into the physics of heat conduction in 2D materials, and demonstrate h-BAs to be a new thermally conductive 2D semiconductor.