First principles high throughput screening of oxynitrides for water-splitting photocatalysts

Energy and Environmental Science - Tập 6 Số 1 - Trang 157-168
Yabi Wu1, Predrag Lazić1, Geoffroy Hautier1, Kristin A. Persson2, Gerbrand Ceder1
1Department of Materials Science and Engineering Massachusetts Institute of Technology, Cambridge, Massachusetts 02139, USA
2Lawrence Berkeley National Laboratory, 1 Cyclotron Rd, Berkeley, California 94720, USA

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