Набор данни - ACSC Molecular Simulation Data Repository

Oxygen diffusion in a vacuum deposited 6wt% Ir(ppy)2(acac):CBP organic...

20 oxygen molecules were inserted at random positions within a vacuum deposited 6wt% Ir(ppy)2(acac):CBP thinfilm and allowed to diffuse (replicate 3 of 3).
- edr
- gro
- tpr
- itp
- log
- top
- mdp
Oxygen diffusion in a vacuum deposited 6wt% Ir(ppy)2(acac):CBP organic...

20 oxygen molecules were inserted at random positions within a vacuum deposited 6wt% Ir(ppy)2(acac):CBP thinfilm and allowed to diffuse (replicate 2 of 3).
- mdp
- edr
- gro
- itp
- tpr
- log
- top
Oxygen diffusion in a vacuum deposited 6wt% Ir(ppy)2(acac):CBP organic...

20 oxygen molecules were inserted at random positions within a vacuum deposited 6wt% Ir(ppy)2(acac):CBP thinfilm and allowed to diffuse (replicate 1 of 3).
- gro
- top
- mdp
- edr
- itp
- tpr
- log

Можете да получите също така достъп до този регистър, като използвате връзката API (see API документация).