Related references
Note: Only part of the references are listed.Machine-Learning-Assisted Determination of the Global Zero-Temperature Phase Diagram of Materials
Jonathan Schmidt et al.
ADVANCED MATERIALS (2023)
Roadmap on Machine learning in electronic structure
H. J. Kulik et al.
ELECTRONIC STRUCTURE (2022)
Data-driven discovery of 2D materials by deep generative models
Peder Lyngby et al.
NPJ COMPUTATIONAL MATERIALS (2022)
Rapid discovery of stable materials by coordinate-free coarse graining
Rhys E. A. Goodall et al.
SCIENCE ADVANCES (2022)
A universal graph deep learning interatomic potential for the periodic table
Chi Chen et al.
NATURE COMPUTATIONAL SCIENCE (2022)
An invertible crystallographic representation for general inverse design of inorganic crystals with targeted properties
Zekun Ren et al.
MATTER (2022)
Computational Discovery of New 2D Materials Using Deep Learning Generative Models
Yuqi Song et al.
ACS APPLIED MATERIALS & INTERFACES (2021)
PyXtal: A Python library for crystal structure generation and symmetry analysis
Scott Fredericks et al.
COMPUTER PHYSICS COMMUNICATIONS (2021)
Crystal graph attention networks for the prediction of stable materials
Jonathan Schmidt et al.
SCIENCE ADVANCES (2021)
Constrained crystals deep convolutional generative adversarial network for the inverse design of crystal structures
Teng Long et al.
NPJ COMPUTATIONAL MATERIALS (2021)
Van der Waals direction transformation induced by shear strain in layered PdSe2
Peng Lv et al.
EXTREME MECHANICS LETTERS (2021)
Atomically Thin Pythagorean Tilings in Two Dimensions
Ahmad W. Huran et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2021)
Semiconducting M2X (M = Cu, Ag, Au; X = S, Se, Te) monolayers: A broad range of band gaps and high carrier mobilities
Lei Gao et al.
NANO RESEARCH (2021)
Two-dimensional binary metal-oxide quasicrystal approximants
Ahmad W. Huran et al.
2D MATERIALS (2021)
Recent progress of the computational 2D materials database (C2DB)
Morten Niklas Gjerding et al.
2D MATERIALS (2021)
High-Throughput Discovery of Novel Cubic Crystal Materials Using Deep Generative Neural Networks
Yong Zhao et al.
ADVANCED SCIENCE (2021)
Quasicrystals and their Approximants in 2D Ternary Oxides
Stefan Foerster et al.
PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS (2020)
Developing an improved crystal graph convolutional neural network framework for accelerated materials discovery
Cheol Woo Park et al.
PHYSICAL REVIEW MATERIALS (2020)
An artificial intelligence-aided virtual screening recipe for two-dimensional materials discovery
Murat Cihan Sorkun et al.
NPJ COMPUTATIONAL MATERIALS (2020)
Materials Cloud, a platform for open computational science
Leopold Talirz et al.
SCIENTIFIC DATA (2020)
2DMatPedia, an open computational database of two-dimensional materials from top-down and bottom-up approaches
Jun Zhou et al.
SCIENTIFIC DATA (2019)
Recent developments in the Inorganic Crystal Structure Database: theoretical crystal structure data and related features
D. Zagorac et al.
JOURNAL OF APPLIED CRYSTALLOGRAPHY (2019)
Recent advances and applications of machine learning in solid-state materials science
Jonathan Schmidt et al.
NPJ COMPUTATIONAL MATERIALS (2019)
A new 2D high-pressure phase of PdSe2 with high-mobility transport anisotropy for photovoltaic applications
Wen Lei et al.
JOURNAL OF MATERIALS CHEMISTRY C (2019)
Inverse Design of Solid-State Materials via a Continuous Representation
Juhwan Noh et al.
MATTER (2019)
Two-dimensional materials from high-throughput computational exfoliation of experimentally known compounds
Nicolas Mounet et al.
NATURE NANOTECHNOLOGY (2018)
The Computational 2D Materials Database: high-throughput modeling and discovery of atomically thin crystals
Sten Haastrup et al.
2D MATERIALS (2018)
PdSe2: Pentagonal Two-Dimensional Layers with High Air Stability for Electronics
Akinola D. Oyedele et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2017)
Density functional perturbation theory for gated two-dimensional heterostructures: Theoretical developments and application to flexural phonons in graphene
Thibault Sohier et al.
PHYSICAL REVIEW B (2017)
Computational Screening of All Stoichiometric Inorganic Materials
Daniel W. Davies et al.
CHEM (2016)
Python Materials Genomics (pymatgen): A robust, open-source python library for materials analysis
Shyue Ping Ong et al.
COMPUTATIONAL MATERIALS SCIENCE (2013)
Materials Design and Discovery with High-Throughput Density Functional Theory: The Open Quantum Materials Database (OQMD)
James E. Saal et al.
JOM (2013)
Quasicrystalline structure formation in a classical crystalline thin-film system
Stefan Foerster et al.
NATURE (2013)
Cuprous iodide - a p-type transparent semiconductor: history and novel applications
Marius Grundmann et al.
PHYSICA STATUS SOLIDI A-APPLICATIONS AND MATERIALS SCIENCE (2013)
Commentary: The Materials Project: A materials genome approach to accelerating materials innovation
Anubhav Jain et al.
APL MATERIALS (2013)
AFLOW: An automatic framework for high-throughput materials discovery
Stefano Curtarolo et al.
COMPUTATIONAL MATERIALS SCIENCE (2012)
Silicene: Compelling Experimental Evidence for Graphenelike Two-Dimensional Silicon
Patrick Vogt et al.
PHYSICAL REVIEW LETTERS (2012)
Specific features of the CuI nanocrystal structure in photochromic glasses
I. Kh. Akopyan et al.
PHYSICS OF THE SOLID STATE (2010)
Crystallography Open Database - an open-access collection of crystal structures
Saulius Grazulis et al.
JOURNAL OF APPLIED CRYSTALLOGRAPHY (2009)
Bilbao crystallographic server. II. Representations of crystallographic point groups and space groups
MI Aroyo et al.
ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES (2006)
Two-dimensional atomic crystals
KS Novoselov et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2005)
Topological study of the periodic system
G Restrepo et al.
JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES (2004)
Electric field effect in atomically thin carbon films
KS Novoselov et al.
SCIENCE (2004)
The NIST surface structure database -: SSD version 4
MA Van Hove et al.
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE (2002)
New developments in the Inorganic Crystal Structure Database (ICSD): accessibility in support of materials research and design
A Belsky et al.
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE (2002)
The Cambridge Structural Database: a quarter of a million crystal structures and rising
FH Allen
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE (2002)
Share Paper
