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Berry curvature signatures in chiroptical excitonic transitions
The topology of the electronic band structure of solids can be described by its Berry curvature distribution across the Brillouin zone. We theoretically introduce and... -
Enhanced spin Hall ratio in two-dimensional semiconductors
The conversion efficiency from charge current to spin current via spin Hall effect is evaluated by the spin Hall ratio (SHR). Through state-of-the-art ab initio calculations... -
Two-dimensional materials from high-throughput computational exfoliation of e...
Two-dimensional (2D) materials have emerged as promising candidates for next-generation electronic and optoelectronic applications. Yet, only a few dozens of 2D materials have... -
Two-dimensional materials from high-throughput computational exfoliation of e...
Two-dimensional (2D) materials have emerged as promising candidates for next-generation electronic and optoelectronic applications. Yet, only a few dozens of 2D materials have... -
Enhanced spin Hall ratio in two-dimensional III-V semiconductors
Spin Hall effect (SHE) plays a critical role in spintronics since it can convert charge current to spin current. Using state-of-the-art ab initio calculations including... -
Electronic and optical properties of the hydrogen boride sheet from the many-...
We study the electronic and optical properties of the hydrogen boride sheet by using the many-body perturbation theory with the perturbative GW (G₀W₀) approximation. It was... -
Quasi two-dimensional molecular layers separated by magnetic and non-magnetic...
One goal of our research into the nanoengineering of molecular magnets is a detailed understanding of the relationship between the structure and composition of a system and its... -
Spin dynamics study in a quasi two-dimensional S = 1/2 triangular antiferroma...
This dataset has no description
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Zero field splitting and quasiparticle breakdown in the two-dimensional quant...
In our recent NRSE experiment on the quasi two-dimensional quantum spin liquid PHCC at TRISP at FRM-II, we have found a zero field splitting (ZFS) of the magnon line of about 50... -
mSR study of a quasi two-dimensional S = 1/2 triangular antiferromagnet, EtMe...
This dataset has no description
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Two-dimensional materials from high-throughput computational exfoliation of ...
Two-dimensional (2D) materials have emerged as promising candidates for next-generation electronic and optoelectronic applications. Yet, only a few dozens of 2D materials have... -
Two-dimensional materials from high-throughput computational exfoliation of ...
Two-dimensional (2D) materials have emerged as promising candidates for next-generation electronic and optoelectronic applications. Yet, only a few dozens of 2D materials have... -
In Silico Design of 2D and 3D Covalent Organic Frameworks for Methane Storage...
Here we present 69,840 covalent organic frameworks (COFs) assembled in silico from a set of 666 distinct organic linkers into 2D-layered and 3D configurations. We investigate... -
Chemical stability of hydrogen boride nanosheets in water
Hydrogen boride sheet is a recently fabricated boron-based two-dimensional nanosheet. For the interest of using it in electronic and catalytic applications, it is important that... -
In Silico Design of 2D and 3D Covalent Organic Frameworks for Methane Storage...
Here we present 69,840 covalent organic frameworks (COFs) assembled in silico from a set of 666 distinct organic linkers into 2D-layered and 3D configurations. We investigate... -
Carbon dioxide adsorption and conversion to methane and ethane on hydrogen bo...
Hydrogen boride (HB) sheets are metal-free two-dimensional materials comprising boron and hydrogen in a 1:1 stoichiometric ratio. In spite of the several advancements, the... -
In Silico Design of 2D and 3D Covalent Organic Frameworks for Methane Storage...
Here we present 69,840 covalent organic frameworks (COFs) assembled in silico from a set of 666 distinct organic linkers into 2D-layered and 3D configurations. We investigate... -
Two-dimensional materials from high-throughput computational exfoliation of ...
Two-dimensional (2D) materials have emerged as promising candidates for next-generation electronic and optoelectronic applications. Yet, only a few dozens of 2D materials have... -
Probing magnetic orbitals and Berry curvature with circular dichroism in reso...
Resonant inelastic X-ray scattering (RIXS) can probe localized excitations at selected atoms in materials, including particle-hole transitions from valence to the conduction...
