49 datasets found

Despite the enormous success and popularity of density functional theory, systematic verification and validation studies are still very limited both in number and scope. Here,...

With the growth of natural gas as an energy source, upgrading CO2-contaminated supplies has become increasingly important. Here we develop a single metric that captures how well...

Despite the enormous success and popularity of density functional theory, systematic verification and validation studies are still very limited both in number and scope. Here,...

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...

Metal–organic frameworks (MOFs), a class of porous materials, are of particular interest in gas storage and separation applications due largely to their high internal surface...

Porous polymer networks (PPNs) are a class of advanced porous materials that combine the advantages of cheap and stable polymers with the high surface areas and tunable...

Despite the enormous success and popularity of density functional theory, systematic verification and validation studies are still very limited both in number and scope. Here,...

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...

With the growth of natural gas as an energy source, upgrading CO2-contaminated supplies has become increasingly important. Here we develop a single metric that captures how well...

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...

Graphs for the Labelled Subgraph Query Benchmark (LSQB), a microbenchmark for graph pattern matching. The graphs were generated by the LDBC Social Network Benchmark's Datagen...

The graphs were generated by the LDBC Social Network Benchmark's Datagen (Hadoop variant, https://github.com/ldbc/ldbc_snb_datagen_hadoop/releases/tag/v0.3.5). The available...

The lineitem table of the TPC-H benchmark's SF100 data set. Stored in Parquet files. Website: https://www.tpc.org/tpch/ Related publications: - TPC Benchmark H, Standard...

Data sets of the SIGMOD 2014 Programming Contest generated by the LDBC Social Network Benchmark's data generator. Stored in zstd-compressed CSV files. Data sets originally...

Small rodent population cycles characterise northern ecosystems, and the cause of these cycles has been a long-lasting central topic in ecology. In the related publication, we...

OpenVirtualObjects (OVO): An open set of standardized and validated 3D household objects for virtual reality-based research, assessment, and therapy.

The poster presents the long-term digital archiving strategy that the Hamburg University Archives (Universitätsarchiv - Universität Hamburg) developed for the...

A public database composed of real-world color polarimetric images of the sky in various weather condition over a month (~ 08-2022) in La Timone, Marseille More information in...

This dataset gather data files and script that are related to the creation of a database for suspect screening analysis of 291 transformation products (TPs) of tebuconazole,...

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...