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Using first-principles calculations based on density-functional theory, we investigated the adsorption of pentacene molecules on monolayer two-dimensional transition metal dichalcogenides (TMD). We considered the four most popular TMDs,…

Materials Science · Physics 2023-11-13 E. Black , P. Kratzer , J. M. Morbec

Using the first-principles calculations based on density functional theory, we systematically investigate the strain-engineering (tensile and compressive strain) electronic, mechanical and transport properties of monolayer penta-SiC$_2$. By…

Materials Science · Physics 2017-01-16 Yuanfeng Xu , Zeyu Ning , Hao Zhang , Gang Ni , Hezhu Shao , Bo Peng , Xiangchao Zhang , Xiaoying He , Yongyuan Zhu , Heyuan Zhu

Structural, electronic, ferroelectric, and optical properties of two-dimensional (2D) BiN monolayer material with phosphorene-like structure are studied in terms of the density functional theory and modern Berry phase ferroelectric method.…

Materials Science · Physics 2017-11-28 Peng Chen , Xue-Jing Zhang , Bang-Gui Liu

Phosphorene, a single atomic layer of black phosphorus, has recently emerged as a new twodimensional (2D) material that holds promise for electronic and photonic technology. Here we experimentally demonstrate that the electronic structure…

Two-dimensional (2D) materials have been studied extensively as monolayers 1-5, vertical or lateral heterostructures 6-8. To achieve functionalization, monolayers are often patterned using soft lithography and selectively decorated with…

Materials Science · Physics 2020-04-15 X Lin , JC Lu , Y Shao , YY Zhang , X Wu , JB Pan , L Gao , SY Zhu , K Qian , YF Zhang , DL Bao , LF Li , YQ Wang , ZL Liu , JT Sun , T Lei , C Liu , JO Wang , K Ibrahim , DN Leonard , W Zhou , HM Guo , YL Wang , SX Du , ST Pantelides , H-J Gao

Black phosphorus has been revisited recently as a new two-dimensional material showing potential applications in electronics and optoelectronics. Here we report the anisotropic in-plane thermal conductivity of suspended few-layer black…

Mesoscale and Nanoscale Physics · Physics 2015-10-20 Zhe Luo , Jesse Maassen , Yexin Deng , Yuchen Du , Richard P. Garrelts , Mark S. Lundstrom , Peide D. Ye , Xianfan Xu

SnTaS2 is a recently discovered layered semimetal exhibiting type-II low transition temperature superconductivity. Except some superconductivity related parameters, most of the physical properties, namely, elastic, mechanical, bonding,…

Materials Science · Physics 2022-07-13 M. I. Naher , M. Mahamudujjaman , A. Tasnim , R. S. Islam , S. H. Naqib

Black phosphorous (BP) is one of the most interesting layered materials, bearing promising potential for emerging electronic and optoelectronic device technologies. The crystalline structure of BP displays in-plane anisotropy in addition to…

Palladium diselenide (PdSe$_2$), a new type of two-dimensional noble metal dihalides (NMDCs), has received widespread attention for its excellent electrical and optoelectronic properties. Herein, high-quality continuous centimeter-scale…

Materials Science · Physics 2021-09-07 MingYang Wei , Jie Lian , Yu Zhang , ChenLin Wang , Yueming Wang , Zhen Xu

Recently, $\beta$-Te (atomically 2D tellurium) with rectangular crystal structure has been synthesized successfully on highly oriented pyrolytic graphite substrates by using molecular beam epitaxy. It has been found possessing remarkable…

Materials Science · Physics 2019-05-21 Gang Liu , Zhibin Gao , Jie Ren

Two-dimensional materials offering ultrafast photoresponse suffer from low intrinsic absorbance, especially in the mid-infrared wavelength range. Challenges in 2d material doping further complicate the creation of light-sensitive $p-n$…

The correlation between the transport properties and structural degrees of freedom of conducting polymers is a central concern in both practical applications and scientific research. In this study, we demonstrated the existence of…

Nanolayered post-transition metal monochalcogenides (PTMMCs) stand out as promising advanced two-dimensional (2D) materials. Beyond inheriting the general advantages associated with traditional 2D materials, they exhibit unique properties,…

Materials Science · Physics 2024-03-06 Mingyu Yu , Maria Hilse , Qihua Zhang , Yongchen Liu , Zhengtianye Wang , Stephanie Law

The group IV-VI compound SnSe, with an orthorhombic lattice structure, has recently attracted particular interest due to its unexpectedly low thermal conductivity and high power factor, showing great promise for thermoelectric applications.…

Materials Science · Physics 2017-01-03 Xiaolong Xu , Qingjun Song , Haifeng Wang , Pan Li , Kun Zhang , Yilun Wang , Kai Yuan , Zichen Yang , Yu Ye , Lun Dai

Perpendicularly magnetized spin injector with high Curie temperature is a prerequisite for developing spin optoelectronic devices on 2D materials working at room temperature (RT) with zero applied magnetic field. Here, we report the growth…

Integrated polarimetric receivers have the potential to define a new generation of lightweight, high-performance instrumentation for remote sensing. To date, on-chip polarization-selective devices such as polarizing beam-splitters have yet…

Optics · Physics 2017-02-21 Jeff Chiles , Tracy Sjaardema , Ashutosh Rao , Sasan Fathpour

A topological insulator possesses a bulk energy gap splitting the lowest empty band from the highest occupied electronic band. The electronic states at the surface (or edge in two dimensions), on the other hand, of a topological insulator…

Materials Science · Physics 2020-05-28 Md. Asif Afzal , S. H. Naqib

Carbon-based materials have attracted great attention due to their exceptional structural diversity and wide-ranging applications. Recently, a new two-dimensional carbon allotrope, named pentagraphene (PG), was proposed. In this study, we…

Two-dimensional thermoelectric materials with a figure of merit $ZT$, which is greater than 2.0 at room temperature, would be highly desirable in energy conversion since the efficiency is competitive to conventional energy conversion…

Materials Science · Physics 2019-07-24 Shenghui Zhang , Xiaobin Niu , Yiqun Xie , Kui Gong , Hezhu Shao , Yibin Hu , Yin Wang

Monolayer molybdenum trioxide (MoO$_3$) is an emerging two-dimensional (2D) material with high electrical conductivity. Using first-principles calculations and a Boltzmann transport theoretical framework, we predict record low…

Materials Science · Physics 2021-06-09 Zhen Tong , Traian Dumitrică , Thomas Frauenheim
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