Lv4
467 积分 2020-11-27 加入
Molecular dynamics simulations of hydrogen production from ammonia borane: Dual promotion by CO2 and alternating electric field
6小时前
求助中
Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density
5天前
已完结
A consistent and accurateab initioparametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
5天前
已完结
Polymer Materials for Optoelectronics and Energy Applications
22天前
已完结
Quantum Chemistry Dataset with Ground- and Excited-state Properties of 450 Kilo Molecules
23天前
已完结
Organic materials repurposing, a data set for theoretical predictions of new applications for existing compounds
1个月前
已完结
Printable high-efficiency organic ionic photovoltaic materials discovered by high-throughput first-principle calculations
1个月前
已完结
Energy Level Prediction of Organic Semiconductors for Photodetectors and Mining of a Photovoltaic Database to Search for New Building Units
1个月前
已完结
PI1M: A Benchmark Database for Polymer Informatics
1个月前
已完结
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