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The European Materials Modelling Council EMMC EMMC Roadmap 2016 Meeting May 20, 2016 Brussels

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Page 1: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

EMMC Roadmap 2016 Meeting May 20, 2016 Brussels

Page 2: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

Nadja Adamovic, General Operational Manager, [email protected]

TU Vienna, Institute of Sensor and Actuator Systems, Gußhausstr. 27-29, 1040 Vienna, Austria

Pietro Asinari, [email protected] di Torino, Department of Energy, Corso Duca degli Abruzzi 24, Torino, Italy

Adham Hashibon, [email protected] Institute for Mechanics of Materials IWM, Woehlerstr. 11, 79108 Freiburg, Germany

Rudolf Koopmans, [email protected] Europe GmbH, R&D Fellow EMEA, Bachtobelstrasse 3, 8810 Horgen, Switzerland

Gerhard Goldbeck, [email protected] Consulting Ltd, St Johns Innovation Centre, Cambridge CB4 0WS, UK

Kersti Hermansson, [email protected]. of Uppsala, Angström Laboratory, Structural Chemistry, Stockholm, Sweden

Erich Wimmer, [email protected] Design sarl, 18 rue de Saisset, Montrouge 92120, France

EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels

Page 3: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

Strength of EuropeMaterials’ modeling is a leading and globally recognized

competency in Europe

Weakness of Europe There was no organized materials modelling community

that represents all stakeholders

Leadership Council has the goal to connect & coordinate the activities of theEuropean Materials Modelling Community.LEIT Meeting, 27th Feb. 2014 in Brussels

Page 4: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

Software Owners(non exhaustive list)

Model developers(non exhaustive list)

Translators(non exhaustive list)

End-Users(non exhaustive list)

LEIT Meeting, 27th Feb. 2014 in Brussels

Page 5: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

EMMC Website http://www.emmc.info

European Materials Modelling Council (EMMC)

is a community driven bottom-up action to connect all existing materialmodelling activities and stakeholders in Europe. The EMMC aims tonetwork with all existing materials modelling related activities in Europeand make use of the EMMC network to complement these activities.

EMMC objectives

• Wide stakeholder consultation• Stimulate complementary activities to what already exists• Stimulate exploitation of existing materials modelling expertise• Stimulate model development necessary for industrial applications• Provide inputs for EC future visions/plans

Page 6: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

EMMC Kick-off Meeting

The kick-off meeting of the EMMC was held on the 5th of November 2014 in Covent Garden, Brussels.

Page 7: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

Materials Modelling PolicyThe Council aims to play a major role in providing input to the LEIT Policyon research road mapping in materials modelling.

EMMC Roadmap 2015 MeetingFebruary 2015

EMMC Roadmap 2016 MeetingMay 2016

EMMC Website http://www.emmc.info

Page 8: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

EMMC Bottom-up action

Participation in the Council

Everybody working in the field of materials modelling or materialsdevelopment (material producers) are welcome to become a member ofEMMC !

1. Review the list of working groups and decide on whattopic you want to work.

2. Fill the participation form and contact the respective work group Operation Team Manager (OTM) or vice-OTM.

3. Join the team and agree your part in the work plan.

Page 9: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

Participation in EMMC

Page 10: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

Participation in EMMC

Page 11: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

Organisation of EMMC

Working groups (WG)The activities within the EMMC are organized within teams or working groups thatare focused on specific goals. Each working group is responsible to develop itsmission and charter which are published on the public site (http://emmc.info).

Operational team managers (OTM)Each EMMC working group has an OTM and vice OTM appointed from among theactive members. The OTM’s are elected by each working group.

Role of the Operational Management Board (OMB)• Leadership, coordination and main operations of the EMMC • Advisory board (for EMMC working groups) • Provide advice to EC for H2020 LEIT Policy on modelling• Increasing awareness on EMMC activities in broad modelling community • Organisation of EMMC Meetings (wide stakeholder consultations) • EMMC publishing material (e.g. newsletters etc.)

Page 12: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

EMMC Industrial Advisory Board (IAB)

EMMC Industrial Advisory Board (IAB)

The EMMC IAB is formed frommembers of the manufacturingstakeholder community. The role ofthe IAB is to guide the EMMC andensure its industrial relevance.

The first task of the IAB was theevaluation and endorsement of theEMMC Roadmap for MaterialsModelling that outlines a strategicfuture materials modelling policy forEurope.

The IAB meets yearly and contributeto the next updates of the EMMCRoadmap.

Page 13: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

International Materials Modelling Board

International Material Modelling Board – IM2B

The International Material Modelling Board – IM2B, acts as a channelfor international collaboration with the EMMC. It is also the way toenable non-EU members to be involved in the EMMC actions.

To join the IM2B, please contact the EMMC operational managementboard (OMB) using the form.

Page 14: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

Current list of members of the IM2B

Last Name First Name Workplace

Itoh Satoshi RIKEN Advanced Institute for Computational Science, Kobe, Japan

Takemura Masahiro Japan Science and Technology Agency (JST)

Lee Kwang-Ryeol Korea Institute of Science and Technology (KIST)

Han Seungwu Seoul National University, South Korea

Warren James Material Genome Initiative; NIST, USA

Court Christa MRI Global, USA

Strachan Alejandro Purdue University, USA

Page 15: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

EMMC Website http://www.emmc.info

Page 16: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

EMMC Working Groups

A number of working groups representing all material modeling stakeholders in Europe have been formed.

1. Decision Support

2. Continuum Models

3. Discrete Models (incl. Electronic-, Atomistic-, Mesoscopic Models, Coupling and Linking)

4. Interoperability

5. Open Simulation Platform

6. Materials Model Marketplace

7. Manufacturers

8. Software Owners

9. Translation and Training

10. Validation

Page 17: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

EMMC Working Groups

Page 18: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

• EMMC Roadmap Meeting 2018-2020 May 20, 2016• CECAM Workshop on Multiscale Simulation: from Materials Through to

Industrial Usage April 21, 2016 • The second Software Solutions in ICME Workshop March 30, 2016 • EMMC Survey of materials modelling development needs March 25, 2016 • The Second EMMC IntOp Workshop, 10.3.2016 March 8, 2016 • Etc.

EMMC Events

Page 19: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

EMMC guidance for Description of Modelling

According to the WP 2016-2017 Introduction (see section 8), from 2016onwards not only the modelling objectives (the phenomena to besimulated) but also the modelling approach (the models and theirinput/output relation, i.e. the “workflows”) will be subject to evaluation bymodelling experts.

The modelling in proposals is expected to be documented following thevocabulary and classification of the RoMM and the guidelines of theEMMC.

Workflow templates and example workflows available online.

Advice for LEIT Proposers

www.emmc.info

Page 20: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

Page 21: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

EMMC guidance for software

Software engineering quality measures are recommended to beincluded in the proposed work plan. Please see the Software QualityAdvice for Academics, a document released by the EMMC for moreinformation. Software engineering quality measures should be taken aspart of the proposed work plan. Please see the document released bythe EMMC for more information.

EMMC guidance on data sharing

Huge amounts of data exist and large parts are non-confidential andcould be of use to others. The EC and also the EMMC are developingways to facilitate increased access to this data. LEIT proposers areasked to consider participation in open data pilot and/or the EuropeanMarketplace initiative.

Advice for LEIT Proposers

www.emmc.info

Page 22: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

EMMC Materials Modelling RoadMap 2015

Page 23: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

EMMC Materials Modelling RoadMap 2015

Page 24: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

EMMC Materials Modelling RoadMap 2015

Key topics needing action

Coordinating Network

Integration of Materials Modelling in Business Processes

Modelling Marketplace

Validation of Materials Models

Page 25: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

EMMC Materials Modelling RoadMap 2015

Page 26: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

WP NMBP 2016/2017

Page 27: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

Update of EMMC Materials Modelling Roadmap 2016

EMMC Survey of materials modellingdevelopment needs

« In this open survey you are invited to provide your views on whatmaterials modelling developments are required in order to respond to theapplication needs of the European industry. The inputs collected via thissurvey will lay the groundwork for elaboration of the EMMC RoadMap2016, a process which will start during a meeting in Brussels on 20thMay 2016, with participation (by invitation) of many active surveycontributors.

The Open survey can be accessed under this link: https://ec.europa.eu/eusurvey/runner/EMMC-materials-modelling-development »

Page 28: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

Update of EMMC Materials Modelling Roadmap 2016

“Please feel free to distribute the link to your own network in order toreach an even broader group of stakeholders.

In addition, if you would like to add your email to the list of stakeholdersfor future EMMC surveys, please join the EMMC by visiting theparticipation page at https://emmc.info/participation/ and filling out thejoining EMMC form.

You may also participate in an open discussion on the various topics andpropose new ones on the EMMC member wiki here (you need to join theEMMC to receive a user name and password for the member wiki).”

The Survey is CLOSED for new inputs

Page 29: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

EMMC Survey of materials modelling developement needs

More than 1500 EU experts were invited to take a part in the Survey

Page 30: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

Major chapters identified in EMMC Survey

Materials modelling development

1. Materials Model Development: Enhancing the use of discrete models

(electronic, atomistic, mesoscopic)

2. Materials Model Development: Enhancing coupling and linking

3. Extracting materials properties from models

4. Extracting the accuracy of different models

5. Integration of materials models with manufacturing and processing (Industry2020)

6. Integration of materials modelling in business processes

7. Materials modelling Market Place and dataspaces

8. Integrated workflows and interoperability including experimental data

9. Coordinating network: Enhancing the uptake of material modelling by manufacturers

10. Are there any broad areas that we are missing?

Page 31: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

Modelling and Health(toxicity and nanomedicine)

MeetingApril 19, 2016, Brussels

The Meeting resulted with the Roadmap on Modelling for Toxicity and Nanomedicine

Topic for EMMC Roadmap Meeting May 20, 2016

Page 32: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

Modelling and Health (toxicity and nanomedicine)

Page 33: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

Major topics identified in EMMC Roadmap 2016

WHAT ARE THE NEXT STEPS ?

EMMC OMB has digested the received feedback (250 replies, 20% manufacturing

industry, 40% software owners)

The results of the Survey will be published on EMMC public website (www.emmc.info)

Result will be presented in the EMMC Roadmap Meeting

May 20, 2016; in EC, Brussels Publicatation of the updated EMMC Roadmap on the public website in June 2016

Page 34: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC

EMMC internal communication and collaboration platform

Page 35: EMMC Presentation, May 20, 2016 · EMMC Roadmap 2016 Meeting , May 20, 2016, Brussels. The European Materials Modelling Council EMMC ... Workflow templates and example workflows available

The European Materials Modelling CouncilEMMC