Benchmarking boron cluster calculations Establishing reliable geometrical and energetic references for Bn (n = 1-4)

von Liu, Lina
Veröffentlicht in: Journal of computational chemistry (2024)

The enhanced extended phenomenological kinetics method to deal with timescale disparity problem among different reaction pathways

von Ding, Chen
Veröffentlicht in: Journal of computational chemistry (2020)

Perturbative treatment of anharmonic vibrational effects on bond distances an extended Langevin dynamics method

von Shen, Tonghao
Veröffentlicht in: Journal of computational chemistry (2014)