Applications of the Liu–Parr–Nagy identity to the spin density calculations

@inproceedings{Morihashi2004ApplicationsOT,
  title={Applications of the Liu–Parr–Nagy identity to the spin density calculations},
  author={Kenji Morihashi and Yasuyo Shimodo and Osamu Kikuchi},
  year={2004}
}
Abstract The Liu–Parr–Nagy identity was applied to the DFT calculations of the spin densities for the NH radical with several exchange-correlation functional sets. The LPN spin density analyses give the important information to understand the differences of spin density values among the exchange-correlation functionals.