Structure, band gap and energy level modulations for obtaining efficient materials in inverted polymer solar cells

Accurate and simple analytic representation of the electron-gas correlation energy

John P. Perdew, Yue Wang · Physical review. B, Condensed matter · 1992 · 24.9K citations

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From molecules to solids with the DMol3 approach

B. Delley · The Journal of Chemical Physics · 2000 · 10.9K citations · Full text

Natural Sciences, Chemistry, Physics +12

An all-electron numerical method for solving the local density functional for polyatomic molecules

B. Delley · The Journal of Chemical Physics · 1990 · 10.5K citations · Full text

Natural Sciences, Chemistry, Computational Chemistry +15

Polymer Photovoltaic Cells: Enhanced Efficiencies via a Network of Internal Donor-Acceptor Heterojunctions

Gang Yu, Jun Gao, Jan C. Hummelen et al. · Science · 1995 · 10.3K citations · Full text

Natural Sciences, Materials Engineering, Materials Science +17

Design Rules for Donors in Bulk‐Heterojunction Solar Cells—Towards 10 % Energy‐Conversion Efficiency

Marcus Scharber, D. Mühlbacher, Markus Koppe et al. · Advanced Materials · 2006 · 5.2K citations

Natural Sciences, Materials Engineering, Materials Science +17