Work

Rapid Discovery of Graphene Nanoflakes with Desired Absorption Spectra Using DFT and Bayesian Optimization with Neural Network Kernel

Year: 2025

Type: article

Source: The Journal of Physical Chemistry A

DOI: 10.1021/acs.jpca.5c00405

Authors: Şener Özönder, Hatice Kübra Küçükkartal

Institutions: Boğaziçi University, Eskişehir Osmangazi University

Language: English

Topic: Machine Learning in Materials Science

Subfield: Materials Chemistry

Field: Materials Science

Domain: Physical Sciences

Open Access status: closed

Funder: Türkiye Bilimsel ve Teknolojik Araştırma Kurumu

Award: Yapay Zeka ve Hesaplamalı Kuantum Mekaniği ile Yeni Nano-Malzemelerin Keşfi

OpenAlex ID: W4410191700

FWCI: 1.24

Cites: 104

Cited by: 6

Related to: 10