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The Uhlenbeck–Ford model in two dimensions: Reference system for fluid-phase ...
<p>We investigate the Uhlenbeck--Ford (UF) model as a reference system for free-energy calculations in two-dimensional (2D) fluids. The 2D virial coefficients are computed... -
Silicon-metal sublayer engineering of honeycomb borophene: DFT-relaxed stru...
<p>The dataset provides crystallographic information (CIF) files for 27 dynamically stable two-dimensional silicon–metal borophene monolayers (Manuscript ID:... -
Data Publication: Exfoliation and Cleavage of Crystals from a Universal Poten...
Primary Research Data for "Exfoliation and Cleavage of Crystals from a Universal Potential" Tom Barnowsky & Rico Friedrich TU Dresden & Helmholtz-Zentrum... -
Data Publication: Exfoliation and Cleavage of Non-van der Waals Materials fro...
Primary Research Data for "Exfoliation and Cleavage of Non-van der Waals Materials from a Universal Potential" Tom Barnowsky & Rico Friedrich TU Dresden &... -
High-throughput calculations of spin Hall conductivity in non-magnetic 2D mat...
Spin Hall effect (SHE) in two-dimensional (2D) materials is promising to effectively manipulate spin angular momentum and identify topological properties. In this work, we... -
Computational dataset for distinct O2 activation regimes and an activation–re...
<p>This record contains the computational data associated with the manuscript “Distinct O<sub>2</sub> activation regimes and an activation–removal... -
Data publication: Non-van der Waals Heterostructures
This dataset includes the primary research data for the publication "Non-van der Waals Heterostructures". -
Data publication: Non-van der Waals Heterostructures
This dataset includes the primary research data for the publication "Non-van der Waals Heterostructures". -
Data publication: Non-van der Waals Heterostructures
This dataset includes the primary research data for the publication "Non-van der Waals Heterostructures". -
Exploring charge density waves in two-dimensional NbSe2 with machine learning
<p>Niobium diselenide (NbSe<sub>2</sub>) has garnered significant attention due to the coexistence of superconductivity and charge density waves (CDWs) down to... -
Search for low-periodic substructures in crystalline solids: a novel approach
<p>This record contains the two-dimensional substructures identified using a novel approach based on the crystal graph construction via Voronoi partition,... -
Data Publication: Kagome Flat Bands from Self-Assembled Water on Non–van der ...
Primary Research Data for "Kagome Flat Bands from Self-Assembled Water on Non–van der Waals 2D Materials" Tom Barnowsky, Madeleine Christie, Anastasiia Nihei,... -
FINDSLAB: Software for Exfoliation and Cleavage of Crystals
FINDSLAB: Software for Exfoliation and Cleavage of Crystals Tom Barnowsky & Rico Friedrich Technische Universität Dresden & Helmholtz-Zentrum Dresden-Rossendorf,... -
Glassy dynamics and crystalline local order in two-dimensional amorphous silica
We reassess the modeling of amorphous silica bilayers as a two-dimensional classical system whose particles interact with an effective pairwise potential. We show that it is... -
Two-dimensional diboron trioxide crystal composed by boroxol groups
<p>Diboron trioxide (B2O3) represents an unusual case among polymorphic oxides, for its vitrified state features superstructural units – planar boroxol... -
Mobility calculation in disordered WS2-Al2O3 stacks from first principles
<p>Transition metal dichalcogenides (TMDCs) are promising candidates for future nano-transistor channels due to their outstanding intrinsic transport properties. However,... -
Machine-learning potential molecular dynamics reveals the critical role of fl...
<div> <div> <div> <p>The confining walls made by 2D materials are often considered as solid boundary conditions in studies of fluid transport through... -
The Materials Cloud 2D database (MC2D)
Two-dimensional (2D) materials are among the most promising candidates for beyond silicon electronic and optoelectronic applications. Recently, their recognized importance,... -
Two-dimensional diboron trioxide crystal composed by boroxol groups
<p>Diboron trioxide (B2O3) represents an unusual case among polymorphic oxides, for its vitrified state features superstructural units – planar boroxol... -
High-throughput screening of 2D materials identifies p-type monolayer WS2 as ...
2D semiconductors are considered as a promising alternative to silicon for future electronics. This class of materials possesses different advantages including atomically sharp...
