Lv4
550 积分 2021-10-15 加入
The water–boryl radical as a proton-coupled electron transfer reagent for carbon dioxide, formic acid, and formaldehyde — Theoretical approach
2天前
已完结
A Systematic and Comparative Analysis of Four Major Classes of DFT Functionals to Compute Linear and Nonlinear Optical Properties of Benchmark Molecules
1个月前
已完结
Formation of a two-dimensional helical square tube ice in hydrophobic nanoslit using the TIP5P water model
1个月前
已完结
The performance of OPC and OPC3 water models in predictions of 2D structures under nanoconfinement
1个月前
已完结
Rich proton dynamics and phase behaviours of nanoconfined ices
1个月前
已完结
Efficient exploration of complex free energy landscapes by stepwise multi-subphase space metadynamics
1个月前
已完结
Inorganic Chemistry
1个月前
已关闭
Electron-transfer reactions involving simple free radicals
2个月前
已完结
Molecular characteristics of sea spray aerosols during aging with the participation of marine volatile organic compounds
2个月前
已完结
Simulation of lithium hydroxide decomposition using deep potential molecular dynamics
2个月前
已完结
皖公网安备34019202002308
