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58 results for News, Computational Electronic Structure Theory (CEST), Computational Electronic Structure Theory (CEST)

CEST researchers receive significant LUMI supercomputing resources

Read how two successful machine learning projects got support by a supercomputer
Research & Art
Published:
White fox walking in winter landscape, technological elements in background with text LUMI

Aalto Open Science Award ceremony brought together Aaltonians to discuss open science

Last week we gathered at A Grid to celebrate the awardees of the Aalto Open Science Award 2023 and discuss open science matters with the Aalto community.
Awards and Recognition, Campus, Research & Art
Published:
Professor Riikka Puurunen, Professor Patrick Rinke and IT Application Owner Lara Ejtehadian holding sunflowers and diplomas

Aalto Open Science Award Third Place Awardee 2023 – Intelligent Robotics Research Group with the Robotic Manipulation of Deformable Objects project

We interviewed the Intelligent Robotics Research Group with the Robotic Manipulation of Deformable Objects project, 3rd place awardees of the first Aalto Open Science Award.
Awards and Recognition, Research & Art
Published:
Two of the awardees and their robotic arm all holding colorful mugs. Aalto Open Science Award, Honorary mention.

Aalto Open Science Award Winner 2023 – Aalto Materials Digitalization Platform (AMAD)

We interviewed the AMAD team, winners of the first Aalto Open Science Award.
Awards and Recognition, Research & Art
Published:
Lara Ejtehadian, Patrick Rinke, and Ilari Lähteenmäki sitting with coffee mugs and smiling to the camera.

New computational method demonstrates improved accuracy and lower computational cost for calculating molecular properties

Researchers benchmark use of separable RI approach in recent journal article
Research & Art
Published:
graphic showing molecules and a bar chart

The winner and runners-up of Aalto University’s Open Science Award 2023

Research Steering Group decided on the winner of the Open Science Award 2023
Awards and Recognition, Research & Art
Published:
Descriptive pic
Aalto Materials Digitalization Platform

How machine learning can support atmospheric compound discovery

Read how machine learning can help identifying new compounds in atmosphere
Research & Art
Published:
graphic showing clouds and chemicals on blue background

Computational study reveals the potential of mixed metal chalcohalides in future photovoltaic applications

Computational screening of photovoltaic materials reveals promising new candidates for future solar applications
Research & Art
Published:
graphic showing work flow with solar panel

Single-atom dopants in metallic nanoparticles can offer high tunability for plasmonic-catalytic applications

CEST researchers use TDDFT-based calculations to study the tunability of the plasmonic-catalytic properties of nanoparticles
Research & Art
Published:
graphic illustratinig metal atoms

Patrick Rinke: making sustainable materials with AI

Professor Patrick Rinke’s pioneering expertise in finding sustainable and climate-friendly materials with machine learning methodology has arguably never been more in demand
Research & Art
Published:
Graphic illustration of materials science, AI and physics with equations, B&W photos and a photo of prof. Rinke.

Matteo Iannacchero, a developer of bio-based yarns: ‘I value the freedom of science’

In his doctoral research conducted at Aalto University’s Bioinnovation Center, Iannacchero uses machine learning to develop ecologically sustainable electronic yarns. This is an opportunity to come up with something completely new.
Research & Art
Published:
Matteo

Machine learning boosts the discovery of new perovskite solar cell materials

Researchers from CEST group apply machine learning to help identifying suitable solar cell materials
Research & Art
Published:
A solar panel with blue sky and a graphic showing perovskite material

Prof. Patrick Rinke Awarded Academy Grant for Developing Biologically Inspired Computing Systems

Prof. Rinke’s three-year joint project with VTT aims to make demanding AI computing tasks use less power while maintaining performance.
Research & Art
Published:
Image of neuromorphic circuits

AI boosts usability of paper-making waste product

Lignin, a side product of wood pulping, is funnelled into new bioproducts with the help of AI
Research & Art
Published:
Graphic showing a birch tree with chemical icons

Making AI fun at Aalto Family Day

CEST group hosted an interactive AI-inspired display at the recent Aalto Family Day
Campus, University
Published:
A group of people including children sitting around desks with monitors

New LOLS machine learning approach facilitates molecular conformer search in complex molecules

A new machine learning method called LOLS speeds up molecular conformer search in complex molecules
Research & Art
Published:
Schematic showing molecules

CEST research acknowledged at Physics Days

Manuel Kuchelmeister received the best poster award at Physics Days 2022
Research & Art
Published:
Picture from the poster

A theoretical surface study of a potential third generation solar cell material opens up prospects for more efficient solar energy conversion

A new article by the CEST group reveals atomic and electronic structure of perovskite material for future photovoltaic applications.
Research & Art
Published:
Picture showing the surface from top and side

School of Science researchers now involved in five Centres of Excellence

SCI researchers are partners in three new Centres of Excellence: Life-Inspired Hybrid Materials, Randomness and structures, and Virtual laboratory for molecular level atmospheric transformations.
Cooperation, Research & Art
Published:
CYBER_Aki-Pekka_Sinikoski010.jpg