Measurement evidence
Framework Dimensional Control Boosting Charge Storage in Conjugated Coordination Polymers · Fan K., Fu C., Chen Y. et al. · Advanced Science · 2023 · 2205760
Reported values remain attached to the sample, method, conditions, extraction quality and source location that produced them.
DFT model of 1D-CuTABQ · Model
Gaussian 16 B3LYP/6-311G(d,p); periodic VASP PBE GGA+U (U=2.5 eV, J=0 eV), DFT-D3, cutoff 450 eV, k mesh 6 x 5 x 4
| Property | Reported value | Normalised value | Uncertainty | Origin and quality | Source |
|---|
DFT model of 2D-CuTABQ · Model
Gaussian 16 B3LYP/6-311G(d,p); periodic VASP PBE GGA+U (U=2.5 eV, J=0 eV), DFT-D3, cutoff 450 eV, k mesh 3 x 2 x 11
| Property | Reported value | Normalised value | Uncertainty | Origin and quality | Source |
|---|