Conference on a FAIR Data Infrastructure for Materials Genomics

Conference on a FAIR Data Infrastructure for Materials Genomics

3 - 5 June, 2020 I virtual meeting


Digital Poster Session

Many young scientists actively participated in the conference as poster presenter. They shared their scientific results with a vibrant scientific community through an abstract, a poster PDF, and a poster pitch video.
The presented results were discussed in virtual breakout rooms.

See their presentations below.


Schedule

Times for the general-track poster sessions:

  • Session 1: June 3 between 10:30 and 12:30 (CEST), this time slot may also serve as a platform to say hello and to "arrive" at the conference
  • Session 2: June 3 between 19:00 and 21:00 (CEST)
  • Session 3: June 4 between 19:00 and 21:00 (CEST)

List of Poster Presentations

Session 1
2Jonathan BeanAutomating Materials ScienceSession 1jb2191@cam.ac.ukDetails ...
3El Tayeb BentriaReactive molecular dynamics understanding of metal dusting corrosion.Session 1ebentria@hbku.edu.qaDetails ...
4Doménica BermeoCytotoxicity prediction of organic molecules using electronic structure simulations and quantitative structure-activity relationships modelingSession 1domenica.bermeo@yachaytech.edu.ecDetails ...
5Jean-Claude CrivelloDiscovering new metal hydrides through machine learningSession 1crivello@icmpe.cnrs.frDetails ...
6Joel DavidssonHigh-Throughput Identication of Point Defects in SiCSession 1joel.davidsson@liu.seDetails ...
7Pierre-Paul De BreuckMODNet: a multi-target material machine learning framework for small data setsSession 1pierre-paul.debreuck@uclouvain.beDetails ...
8Siddharth DixitMachine Learning Approaches to Identify and Design Low Thermal Conductivity Oxides for Thermoelectric ApplicationsSession 1sd882@snu.edu.inDetails ...
9Tao FanAICON: A program for calculating thermal conductivity quickly and accuratelySession 1tao.fan@skoltech.ruDetails ...
10Alexandre FoggiattoPrediction of Physical Parameters from Microscopic Images Using Topological Data AnalysisSession 1a.foggiatto@rs.tus.ac.jpDetails ...
11Sourav GhoshData-driven prediction of specific capacitance of supercapacitor for novel electrode materials: a case study on cerium oxynitrideSession 1mm17d301@smail.iitm.ac.inDetails ...
13Hyun Woo KimExtended graph convolutional network and its application to predict molecular propertiesSession 1ahwk@krict.re.krDetails ...
14Martin KubanThe NOMAD Encyclopedia - a web-based tool for exploring materials dataSession 1kuban@physik.hu-berlin.deDetails ...
15Markus KühbachOn Strong Scaling and Open Source Tools for Analyzing Atom Probe Tomography (APT) Data and Assisting the Community to Align with FAIRSession 1m.kuehbach@mpie.deDetails ...
16Marcel LangerRepresentations of atomistic systems for machine learningSession 1langer@fhi-berlin.mpg.deDetails ...
17Andreas LeithererCrystal-structure identification via Bayesian deep learningSession 1leitherer@fhi-berlin.mpg.deDetails ...
18Maja-Olivia LenzOntologies in Computational Materials ScienceSession 1lenz@fhi-berlin.mpg.deDetails ...
19Tomohiro MatsushitaData analysis for 3D local atomic structure around dopantsSession 1t-matusita@ms.naist.jpDetails ...
Session 2
20Patrick OppermannELOG and EPICS - electronic laboratory book and open-source data acquisitionSession 2oppermann@fhi-berlin.mpg.deDetails ...
22Thomas PurcellHigh-Precision yet Efficient High-Throughput Search for Thermal InsulatorsSession 2purcell@fhi-berlin.mpg.deDetails ...
23Raghunathan RamakrishnanHigh-throughput modeling of auto-ignition reaction pathways across the chemical space of hydrocarbonsSession 2ramakrishnan@tifrh.res.inDetails ...
24Joshua SalazarAb-initio studies of ultra-thin CaF2 layers on the Si(100) surfaceSession 2joshua.salazar@yachaytech.edu.ecDetails ...
25Markus ScheidgenNOMAD Repository and ArchiveSession 2markus.scheidgen@physik.hu-berlin.deDetails ...
26Byung Chul YeoAutomatic Identification of Crystallographic Interfaces from Scanning Transmission Electron Microscopy Data by Artificial IntelligenceSession 2yeo@fhi-berlin.mpg.deDetails ...
27Sutapa Mondal RoyAntibacterial drugs stabilized noble metal nanomaterials: A joint spectroscopic and DFT investigation for the manifestation of novel biological insights.Session 2sutapa.roy@utu.ac.inDetails ...
28Duong-Nguyen NguyenScreening new Nd-Fe-B crystals: full insight of local structure and structural stability relationship with Machine learningSession 2nguyennd@jaist.ac.jpDetails ...
29Prince GollapalliOn the Origin of Chemically Graded Metal/Ceramic Interface: A High Throughput DFT StudySession 2prince.gollapalli@gmail.comDetails ...
31Anjana TalapatraMachine-Learning Based Discovery of Novel Oxide PerovskitesSession 2atalapatra@lanl.govDetails ...
32Debesh Ranjan RoyDeveloping Smart Materials from Atomic ClustersSession 2drr@phy.svnit.ac.inDetails ...
33Minh Quyet HaDescriptor free recommender system for new high-entropy alloys: An application of the evidence theorySession 2minhquyet@jaist.ac.jpDetails ...
35Christoph KochFilling in Missing Links of a FAIR Data Infrastructure for Electron MicroscopySession 2christoph.koch@hu-berlin.deDetails ...
37Masato KotsugiTopological data analysis for magnetic domain structure characterizationSession 2kotsugi@rs.tus.ac.jpDetails ...
38Takuya KadohiraMaterials Data Platform System toward implementation of FAIR data principlesSession 2kadohira.takuya@nims.go.jpDetails ...
39Cheng WenMachine learning assisted design of high entropy alloys with desired propertySession 2wcheng.3jia@163.comDetails ...
41Lucas FoppaMaterials-genome (descriptor) identification by the hierarchical SISSO approachSession 2foppa@fhi-berlin.mpg.deDetails ...
42Masahiro YamamotoCombinatorial fabrication and spectroscopic analysis of Fe-Co-Cr ternary alloy thin filmSession 28219585@ed.tus.ac.jpDetails ...
43Jorge CastroDelta Chem: A new geometric approach of porosity for symmetric porous materialsSession 2jcastromda316@gmail.comDetails ...
44Santosh BeharaProspects for data science techniques in phosphor researchSession 2santosh223.iiitn@gmail.comDetails ...
50Jorge CardenasStudy of conductance and spin selective in a DNA modelSession 2jorge.cardenas@yachaytech.edu.ecDetails ...
Session 3
45Tatyana ShevelevaSTREAM Project: Semantic Representation, Networking and Curation of Quality Assured Material DataSession 3tatyana.sheveleva@tib.euDetails ...
47Doménica Nicole GarzónAb initio studies on the atomic and electronic structure of nobel graphene-based superlattices.Session 3domenica.garzon@yachaytech.edu.ecDetails ...
48Edwin Vásconez LopezFirst-principles studies of the electronic and mechanical properties of α-Al/γ-Al2O3(111) multilayer composite.Session 3edwin.vasconez@yachaytech.edu.ecDetails ...
49Jorge VegaLiNbS2 electronic and atomic structure analysis starting from open access materials' informationSession 3jorge.vega@yachaytech.edu.ecDetails ...
51Fabian PugaIn Silico prediction of antibacterial activity of sesquiterpene lactones using density-functional theory and quantitative structure-activity relationship methodsSession 3fabian.puga@yachaytech.edu.ecDetails ...
52Yan ZhangPhase prediction in high entropy alloys with a rational selection of materials descriptors and machine learning modelsSession 3ustbcw1201zy@163.comDetails ...
53Ray MiyazakiTheoretical Study of C-H Bond Activation by O2 on Negatively Charged Au Cluster CatalystSession 3ray_miyazaki@cat.hokudai.ac.jpDetails ...
54Carlos Manuel de ArmasSupervised Machine Learning with electronic description for fast spectroscopic predictionSession 3carlosdearmasm@gmail.comDetails ...
55Hyunju ChangTransfer Learning for Small Datasets in Materials ScienceSession 3hjchang@krict.re.krDetails ...
56Pei LiuMachine learning assisted design of gama'-strengthened Co-base superalloys with multi-performance optimizationSession 3b20180572@xs.ustb.edu.cnDetails ...
57Luca FoppianoAutomatic construction of an accessible linked dataset from scientific literature for superconducting materials discoverySession 3foppiano.luca@nims.go.jpDetails ...
58Huanyu LiAn Ontology for the Materials Design DomainSession 3huanyu.li@liu.seDetails ...
59Mehdi NourazarAb-initio simulations of point defects and diffusion in cubic carbidesSession 3mehdin@kth.seDetails ...
61Daniel SpeckhardError Estimation of Energy-per-Atom of Binary Compounds using Statistical LearningSession 3speckhard@fhi-berlin.mpg.deDetails ...
62Luigi SbailoWeb-based artificial intelligence tools for materials science: the NOMAD analytics toolkitSession 3sbailo@fhi-berlin.mpg.deDetails ...
63Gabriel Schleder2D Materials Thermodynamic Stability via Machine LearningSession 3gabriel.schleder@ufabc.edu.brDetails ...
64Fabio Le PianePredicting the properties of molecular materials: multiscale simulation workflows meet machine learningSession 3fabio.lepiane@ismn.cnr.itDetails ...
65Xiaojuan HuShare and represent a large data set of cation-coordinated conformers of 20 proteinogenic amino acidsSession 3xhu@fhi-berlin.mpg.deDetails ...
66Heesoo ParkStructural Deformation Feature Improves the Prediction Accuracy in Hybrid Perovskite BandgapsSession 3hpark@hbku.edu.qaDetails ...

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Page last modified on June 09, 2020, at 06:29 PM EST