标题
Performance of genetic algorithms in search for water splitting perovskites
作者
关键词
Genetic Algorithm, Perovskite, Fitness Function, Density Functional Theory Computation, Random Search
出版物
JOURNAL OF MATERIALS SCIENCE
Volume 48, Issue 19, Pages 6519-6534
出版商
Springer Nature
发表日期
2013-05-24
DOI
10.1007/s10853-013-7448-9
参考文献
相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。- The Computational Materials Repository
- (2012) David D. Landis et al. COMPUTING IN SCIENCE & ENGINEERING
- New cubic perovskites for one- and two-photon water splitting using the computational materials repository
- (2012) Ivano E. Castelli et al. Energy & Environmental Science
- From the computer to the laboratory: materials discovery and design using first-principles calculations
- (2012) Geoffroy Hautier et al. JOURNAL OF MATERIALS SCIENCE
- Computational design of low-band-gap double perovskites
- (2012) Robert F. Berger et al. PHYSICAL REVIEW B
- Genetic-Algorithm Discovery of a Direct-Gap and Optically Allowed Superstructure from Indirect-Gap Si and Ge Semiconductors
- (2012) Mayeul d’Avezac et al. PHYSICAL REVIEW LETTERS
- How Evolutionary Crystal Structure Prediction Works—and Why
- (2011) Artem R. Oganov et al. ACCOUNTS OF CHEMICAL RESEARCH
- A high-throughput infrastructure for density functional theory calculations
- (2011) Anubhav Jain et al. COMPUTATIONAL MATERIALS SCIENCE
- Computational screening of perovskite metal oxides for optimal solar light capture
- (2011) Ivano E. Castelli et al. Energy & Environmental Science
- Screening for high-performance piezoelectrics using high-throughput density functional theory
- (2011) Rickard Armiento et al. PHYSICAL REVIEW B
- Identifying the 'inorganic gene' for high-temperature piezoelectric perovskites through statistical learning
- (2011) P. V. Balachandran et al. PROCEEDINGS OF THE ROYAL SOCIETY A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES
- Trends in Stability of Perovskite Oxides
- (2010) Federico Calle-Vallejo et al. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
- Finding Nature’s Missing Ternary Oxide Compounds Using Machine Learning and Density Functional Theory
- (2010) Geoffroy Hautier et al. CHEMISTRY OF MATERIALS
- Data Mined Ionic Substitutions for the Discovery of New Compounds
- (2010) Geoffroy Hautier et al. INORGANIC CHEMISTRY
- Electronic structure calculations with GPAW: a real-space implementation of the projector augmented-wave method
- (2010) J Enkovaara et al. JOURNAL OF PHYSICS-CONDENSED MATTER
- Kohn-Sham potential with discontinuity for band gap materials
- (2010) M. Kuisma et al. PHYSICAL REVIEW B
- Accurate ab initio energy gradients in chemical compound space
- (2009) O. Anatole von Lilienfeld JOURNAL OF CHEMICAL PHYSICS
- Data mining and accelerated electronic structure theory as a tool in the search for new functional materials
- (2008) C. Ortiz et al. COMPUTATIONAL MATERIALS SCIENCE
- Exploring chemical space with discrete, gradient, and hybrid optimization methods
- (2008) D. Balamurugan et al. JOURNAL OF CHEMICAL PHYSICS
- Band-Gap Design of Quaternary (In,Ga)(As,Sb) Semiconductors via the Inverse-Band-Structure Approach
- (2008) Paulo Piquini et al. PHYSICAL REVIEW LETTERS
Find Funding. Review Successful Grants.
Explore over 25,000 new funding opportunities and over 6,000,000 successful grants.
ExploreAdd your recorded webinar
Do you already have a recorded webinar? Grow your audience and get more views by easily listing your recording on Peeref.
Upload Now