Automated property optimization via ab initio O(N) elongation method: Application to (hyper-)polarizability in DNA
Author:
Affiliation:
1. Department of Material Sciences, Faculty of Engineering Sciences, Kyushu University, 6-1 Kasuga-Park, Fukuoka 816-8580, Japan
2. Japan Science and Technology Agency, CREST, 4-1-8 Hon-chou, Kawaguchi, Saitama 332-0012, Japan
Funder
Japan Society for the Promotion of Science (JSPS)
Core Research for Evolutional Science and Technology (CREST)
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.4956456
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