Matches in SemOpenAlex for { <https://semopenalex.org/work/W4366749181> ?p ?o ?g. }
Showing items 1 to 72 of
72
with 100 items per page.
- W4366749181 abstract "Two-dimensional (2D) materials have been a research hot topic in the passed decades due to their unique and fascinating properties. Among them, mechanical properties plays an important role for their application. However, there lacks an effective tool for high-throughput calculating, analysing and visualizing the mechanical properties of 2D materials. In this work, we present, mech2d package, a highly automated toolkit for calculating and analysing second-order elastic constants (SOECs) tensor and relevant properties of 2D materials with considering their symmetry. In the mech2d, the SOECs can be fitted by both strain-energy and stress-strain approach, where the energy or strain can be calculated by first-principles engine, such as VASP. As a key feature, the mech2d package can automatically submit and collect the tasks from local or remote machine with robust fault-tolerant ability, make it suitable for high-throughput calculation. The present code has been validated by several common 2D materials, including graphene, black phosphorene, GeSe2 and so on." @default.
- W4366749181 created "2023-04-24" @default.
- W4366749181 creator A5021555728 @default.
- W4366749181 creator A5026108994 @default.
- W4366749181 creator A5062631778 @default.
- W4366749181 creator A5068858679 @default.
- W4366749181 creator A5083295615 @default.
- W4366749181 creator A5086326013 @default.
- W4366749181 creator A5088259588 @default.
- W4366749181 date "2023-04-21" @default.
- W4366749181 modified "2023-10-04" @default.
- W4366749181 title "mech2d: An Efficient Tool for High-Throughput Calculation of Mechanical Properties for Two-Dimensional Materials" @default.
- W4366749181 doi "https://doi.org/10.20944/preprints202304.0676.v1" @default.
- W4366749181 hasPublicationYear "2023" @default.
- W4366749181 type Work @default.
- W4366749181 citedByCount "0" @default.
- W4366749181 crossrefType "posted-content" @default.
- W4366749181 hasAuthorship W4366749181A5021555728 @default.
- W4366749181 hasAuthorship W4366749181A5026108994 @default.
- W4366749181 hasAuthorship W4366749181A5062631778 @default.
- W4366749181 hasAuthorship W4366749181A5068858679 @default.
- W4366749181 hasAuthorship W4366749181A5083295615 @default.
- W4366749181 hasAuthorship W4366749181A5086326013 @default.
- W4366749181 hasAuthorship W4366749181A5088259588 @default.
- W4366749181 hasBestOaLocation W43667491811 @default.
- W4366749181 hasConcept C127413603 @default.
- W4366749181 hasConcept C155281189 @default.
- W4366749181 hasConcept C157764524 @default.
- W4366749181 hasConcept C171250308 @default.
- W4366749181 hasConcept C18762648 @default.
- W4366749181 hasConcept C192562407 @default.
- W4366749181 hasConcept C2524010 @default.
- W4366749181 hasConcept C2777208637 @default.
- W4366749181 hasConcept C30080830 @default.
- W4366749181 hasConcept C33923547 @default.
- W4366749181 hasConcept C41008148 @default.
- W4366749181 hasConcept C459310 @default.
- W4366749181 hasConcept C555944384 @default.
- W4366749181 hasConcept C76155785 @default.
- W4366749181 hasConcept C78519656 @default.
- W4366749181 hasConceptScore W4366749181C127413603 @default.
- W4366749181 hasConceptScore W4366749181C155281189 @default.
- W4366749181 hasConceptScore W4366749181C157764524 @default.
- W4366749181 hasConceptScore W4366749181C171250308 @default.
- W4366749181 hasConceptScore W4366749181C18762648 @default.
- W4366749181 hasConceptScore W4366749181C192562407 @default.
- W4366749181 hasConceptScore W4366749181C2524010 @default.
- W4366749181 hasConceptScore W4366749181C2777208637 @default.
- W4366749181 hasConceptScore W4366749181C30080830 @default.
- W4366749181 hasConceptScore W4366749181C33923547 @default.
- W4366749181 hasConceptScore W4366749181C41008148 @default.
- W4366749181 hasConceptScore W4366749181C459310 @default.
- W4366749181 hasConceptScore W4366749181C555944384 @default.
- W4366749181 hasConceptScore W4366749181C76155785 @default.
- W4366749181 hasConceptScore W4366749181C78519656 @default.
- W4366749181 hasLocation W43667491811 @default.
- W4366749181 hasLocation W43667491812 @default.
- W4366749181 hasOpenAccess W4366749181 @default.
- W4366749181 hasPrimaryLocation W43667491811 @default.
- W4366749181 hasRelatedWork W160116885 @default.
- W4366749181 hasRelatedWork W1967383368 @default.
- W4366749181 hasRelatedWork W1970648120 @default.
- W4366749181 hasRelatedWork W2011083790 @default.
- W4366749181 hasRelatedWork W2059929079 @default.
- W4366749181 hasRelatedWork W2322403445 @default.
- W4366749181 hasRelatedWork W2477853911 @default.
- W4366749181 hasRelatedWork W2526884355 @default.
- W4366749181 hasRelatedWork W2625512991 @default.
- W4366749181 hasRelatedWork W2950363298 @default.
- W4366749181 isParatext "false" @default.
- W4366749181 isRetracted "false" @default.
- W4366749181 workType "article" @default.