Response analysis of orthotropic steel deck pavement based on interlayer contact bonding condition

In this research the interlayer contact condition was considered between the adjacent layers of orthotropic steel deck pavement, and an interface contact bonding model was applied to simulate the interlayer bonding condition and evaluate the response of deck pavement under vehicle loads. An advantage of this model is that it can simulate not only the full-bond condition but also the debonding condition at somewhere between adjacent layers. The responses of the orthotropic steel deck pavement were calculated and analyzed by the model, and it found that this model is reasonable and credible to evaluate the responses of the deck pavement comparing with the previous researches. The full-bond condition was an ideal condition between adjacent layers, which was prone to underestimate the responses and deformation of the deck pavement. Moreover, the position and size of the disengaging area have a notable influence on the tensile strain at the top of SMA layer and the bottom of GA layer, and the tensile strain of them also increase with the increase of the disengaging area. Finally, the responses of the steel deck pavement changed obviously when the vehicle speed increase, so the suitable speed limit may reduce the responses and deformation for prolonging the service life of the orthotropic steel deck pavement.

Reconstruction and electronic properties of β-Li3PS4 |Li2S interface

The morphology and properties of the interface between solid electrolyte and electrode have important impacts on all-solid-state lithium-sulfur batteries’ performance. We used the first-principles calculations to explore the interface between Li2S cathode and β-Li3PS4 (lithium thiophosphate, LPS) solid electrolyte, including lattice structure, mechanical, electrical properties, interface contact type, and charge distribution in real space. It is found that the interface is significantly reconstructed, and the Li atoms at the interface move mainly parallel to the interface plane. The interface density states introduce metallic properties, mainly contributed by the Li-s and S-s, -p orbitals in Li2S and S-p orbitals in LPS. The highest occupied molecular orbitals of the LPS electrolyte are lower than the electrochemical potential (Fermi level) of the Li2S cathode, thus the electrolyte and cathode materials are reasonable and stable in thermodynamics. Interface density of states shows electrons on the interface do not penetrate from Li2S into LPS, and do not leak electrons to cause electron conduct in LPS. Besides, the interface is an n-type Schottky barrier with a barrier value of 1.0 eV. The work-function of the interface indicates that there is a space charge layer by the redistribution of electrons, which is in agreement with the result of interface charge density difference. The electron/hole pairs will be separate, realizing high current charge and discharge capability because of the space charge layer.

An All-Solid-State Lithium Metal Battery Based on Electrodes-Compatible Plastic Crystal Electrolyte

Solid-state plastic crystal electrolytes (SPCEs) have attracted much attention due to their high ionic conductivity at room temperature and polymer-like plasticity. Herein, we made a LiFePO4||Li solid state battery based on SPCEs. A SPCE film is made up of glass fiber, succinonitrile (SN), lithium bis (triflu-romethanesulphonyl) imid (LiTFSI), and LiNO3. Glass fiber is introduced to improve the mechanical property, and LiNO3 served as an additive to stabilize electrolyte/Li interface. The SPCE film delivers a high ionic conductivity of 7.3 × 10−4 S cm−1 at room temperature and has excellent stability with Li-metal anode. SPCE is also infused into cathode electrode and used as the interface with cathode particles, which can access a large interface contact area and deform reversibly with volume change. The LiFePO4||Li solid state battery based on SPCE can work well at ambient temperature, which shows a high initial specific capacity of 121.4 mAh g−1 and has 86.9% retention after 90 cycles at 0.5 C.

INTERCAAT: identifying interface residues between macromolecules

Summary The Interface Contact definition with Adaptable Atom Types (INTERCAAT) was developed to determine the atomic interactions between molecules that form a known three dimensional structure. First, INTERCAAT creates a Voronoi tessellation where each atom acts as a seed. Interactions are defined by atoms that share a hyperplane and whose distance is less than the sum of each atoms’ Van der Waals radii plus the diameter of a solvent molecule. Interacting atoms are then classified and interactions are filtered based on compatibility. INTERCAAT implements an adaptive atom classification method; therefore, it can explore interfaces between a variety macromolecules. Availability and implementation Source code is freely available at: https://gitlab.com/fiserlab.org/intercaat. Supplementary information Supplementary data are available at Bioinformatics online.