88 datasets found

We explore the interplay between ferroelectricity and metallicity, which are generally considered to be contra-indicated properties, in the prototypical ferroelectric barium...

The effects of the finite size of the simulation box in equilibrium molecular dynamics simulations are investigated for prototypical superionic conductors of different types,...

Dynamical perturbations modify the states of classical systems in surprising ways and give rise to important applications in science and technology. For example, Floquet...

The development of rechargeable batteries based on a Ca metal anode demands the identification of suitable cathode materials. This work investigates the potential application of...

The application of machine learning to the modeling of materials and molecules has proven to be extremely successful in accelerating the understanding, design, and...

Nonlinear interactions between excitons strongly coupled to light are key for accessing quantum many-body phenomena in polariton systems. Atomically-thin two-dimensional...

CO is the simplest product from CO2 electroreduction (CO2R), but the identity and nature of its rate limiting step remains controversial. Here we investigate the activity of...

Singlet fission (SF) is a two-step process in which a singlet splits into two triplets throughout the so-called correlated triplet-pair (1TT) state. Intramolecular SF (iSF)...

This deliverable consists of the technical report from task 4.1 “Compute and Analysis” on the integration of B2-services and object storage services, and from task 4.4...

The document is the final report on the activities that were carried out during the project in the area of training. It includes reporting on the events (hackathons and...

This document is the first version of the DICE data management plan. It provides information on the type of data being produced by the project, their sources and how the...

Presentation given by Sarah Jones at the INDIGO Data Management Services in the Cloud workshop held at the 9th RDA Plenary in Barcelona

Présentation given by Stéphane Coutin during the PRACE 2017 Spring School joint training event with the EU H2020 VI-SEEM project (https://vi-seem.eu/) organised by CaSToRC at...

The document is the final report on the activities that were carried out during the project to steer the DICE users’ engagement according to the communication and dissemination...

This deliverable describes the use cases integration of the platforms selected, and validation of the implementation work, with a consideration of their impact so far.

This deliverable includes the final report about the integration of data services with computing platforms, the integration of PID Graph resources in B2FIND, the implementation...

First report on the initial design of the integration architecture. The main focus is on the planned integration activities of the Collaborative Data Infrastructure (CDI)...

The document defines the marketing, communication & dissemination strategy and the activities that will be carried out during the project to steer the DICE users’ engagement.

The deliverable explains four main tasks of the DICE work package Federated Service Management: the general operations coordination, helpdesk management, order management and...

This is the intermediate report on the integration of services. The main focus is on the integration activities of the Collaborative Data Infrastructure (CDI) Operation and...