NoMaD project deliverables
The page lists 25 deliverables related to the research project "NoMaD".
List of Deliverables
| title and desprition | type | last update |
|---|---|---|
Workshop & Tutorials summaryThis document reports on the academic workshops (at M3 and M18) and the one-day hands-on tutorials described in Task 6 of WP7. The core of the report is the presentations and tutorial training materials; the report also briefly describes the feedback from the participants and suggestions for the final academic workshop at M36. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Documents, reports | 2019-09-05 |
Analytics toolkit – final deploymentUpdated NoMaD-analytics-toolkit with advanced algorithms and fully worked-out tutorials. This toolkit builds on D4.1 and D4.2. In addition to existing functionality, this deployment includes new methods and optimisation of existing methods. Four possible examples include (a) a feature space which contains non-correlated elementes; (b) a general purpose feature space for materials science; (c) new understanding of the causal relationship between the descriptor and property P; (d) a descriptor to predict solubilities using classical free-energy calculations. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Other | 2019-09-05 |
Research manuscriptsResearch manuscript(s) on compressed sensing approached of the Kohn-Sham wavefunctions and molecular dynamics trajectories will be written. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Documents, reports | 2019-09-05 |
Final assessment of visualization toolsUser perception and value of the visualisation tools, in their completed form will be documented in a report. This will inform future work, highlight the most appropriate and useful visualisations for complex and multi-dimensional data, and act as a requirements capture resource for further development. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Documents, reports | 2019-09-05 |
Dissemination reportThis report will survey all dissemination activities throughout the project, and report on them all. It will then analyse the levels of engagement and impact of the dissemination activities, and highlight opportunities for improvement, particular succeses, challenges and solutions, so that this knowledge can be applied beyond the project. Business dissemination (q.v. WP5) will also be considered here. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Documents, reports | 2019-09-05 |
Final report on HPC platformThis report describes the technology platform at the end of the project. It explores how the platform changed and evolved during the project to meet user needs, and what lessons can be learnt for future projects in similar domains, so that HPC can optimally support them. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Documents, reports | 2019-09-05 |
Summary of data workshopsA report on the activities, presentations, and results of the two data workshops (MS9, MS11). The report will include the aims of the workshops, the process followed, the key data shared and discussed, the decisions taken and the actions agreed. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Documents, reports | 2019-09-05 |
Project documentary videoA professionally-produced video that describes the aims and approach of the project and the benefits to the scientific and industrial communities. The video will be available for download from the project website, on YouTube and similar sites, and from partner sites. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Websites, patent fillings, videos etc. | 2019-09-05 |
First 40 conversion layersThe “conversion layers†and compression algorithms for output data will be implemented for 40 leading electronic structure codes. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Other | 2019-09-05 |
Graphical user interfaceWeb-based graphical user interface (GUI) of the search engine. The GUI will display the results of the queries in an interactive manner, displaying properties and functions, e.g. in tables and figures and providing links to the underlying data. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Demonstrators, pilots, prototypes | 2019-09-05 |
Analytics toolkit – initial deploymentThe first deployment of the NoMaD-analytics-toolkit, with working examples of traditional machine-learning algorithms. This will consist of a portfolio of software components, built on Apache Flink or a similar technology, each of which addresses a specific data analytics task. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Other | 2019-09-05 |
Data management planThis plan outlines what data will be generated by the project; its format and scope; how and where it will be stored, backed up, curated and preserved (where appropriate); any protection or security it requires; how it will be shared in the future in any open data repository; and any conditions for access. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Open Research Data Pilot | 2019-09-05 |
HPC platform requirements and architecture reportThis document records the inputs and requirements of the domain users (the materials scientists) for the HPC platform on which the CoE relies. It also translates these requirements into architecture specifications and designs, showing how the requirements will be met using HPC resources Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Documents, reports | 2019-09-05 |
Code-independent databaseThe scalable database to host and manage the code-independent data will be created. This consists of an object-relational database (e.g., PostgreSQL) and a distributed file system (e.g. HDFS). Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Other | 2019-09-05 |
Terms of Reference – SAC and IACThe terms of reference provide the advisory committees with the background information they require to be of maximum value to the project. They include (a) information about the aims and approach of the project [from the DoA, plus presentations and discussions with the team]; (b) a description of the information and inputs they will receive during the project; (c) an outline of the inputs requested from the committee membesr, in terms of scope, frequency and level of detail; and (d) the manner in which the project team (especially the coordinator) and the SAC/IAC members are expected to contact and engage with one another. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Documents, reports | 2019-09-05 |
Query algorithmsAlgorithms for complex queries. Searches will either combine ground-state properties, molecular-dynamics simulations and/or various excitations as computed for one material or cover one specific property or function across one or more material classes. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Other | 2019-09-05 |
Dissemination materialsThese materials will be produced in the opening months of the project, in order to have resources for distribution at conferences, meetings, industry briefings, etc. They will focus on the aims and approach of the project, and its expected impact. The newsletters will be produced at M12, M24 and M36, and will primarily describe the progress of the project during the relevant year. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Websites, patent fillings, videos etc. | 2019-09-05 |
Remote visualization guideA user guide will be written which documents the information which can be visualised and how the visualisation tools are best used. It also also describes the different ways in which the visualisations can be presented. Such visualisation models include ‘ball-and-stick’, structured and unstructured grids, and data abstractions for multidimensional parameters. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Websites, patent fillings, videos etc. | 2019-09-05 |
Demonstration of the search engine for one material classDemonstration how a material is characterised by the NoMaD search engine for one selected material class out of metals, inorganic and organic semiconductors, surfaces, interfaces, clusters, molecules, atoms. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Demonstrators, pilots, prototypes | 2019-09-05 |
Analytics toolkit – interim deploymentUpdated NoMaD-analytics-toolkit with advanced algorithms and fully worked-out tutorials. This toolkit builds on D4.1 and D4.2. In addition their functionality, this deployment includes new methods and optimisation of existing methods. Four possible examples include (a) a feature space which contains non-correlated elementes; (b) a general purpose feture space for materials science; (c) New understanding of the causal relationship between the descriptor and property P; (d) a descriptor to predict solubilities using classical free-energy calculations. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Other | 2019-09-05 |
First 30 conversion layersThe “conversion layers†and compression algorithms for output data will be implemented for the first 30 leading electronic structure codes. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Other | 2019-09-05 |
Website industrial sectionThis section of the NoMaD CoE website will be added to D7.1, and will focus specifically on what NoMaD CoE can offer to the industrial community: what information we will generate, how this can be used, and (critically) how to engage with the NoMaD team and discover how the CoE can address industrial R&D needs. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Websites, patent fillings, videos etc. | 2019-09-05 |
WebsiteThe project website, with its associated Twitter feed, YouTube channel and facebook page, is the online ‘shop window’ of the project. In its initial form it will summarise the key parts of NoMaD (project aims, project team, approach and science, impact and value); it will be updated on an ongoing basis, with news and information on project developments. Links to (and information from) other CoEs and related projects will be highlighted. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Websites, patent fillings, videos etc. | 2019-09-05 |
First assessment of visualization toolsFollowing initial release and review of the visualisation tools, the feedback received from users will be documented in a report. This report will facilitate further refinement and design of the visualisation system, so that it better meets the needs of end-users. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Documents, reports | 2019-09-05 |
Data formats and compressionThe code-independent formats used to store all relevant output quantities of atomistic simulations will be defined, described and documented. Programme: H2020-EU.1.4.1.3. - Topic(s): EINFRA-5-2015 |
Documents, reports | 2019-09-05 |