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Autor:
Nayuta Suzuki1 suzukin15@chem.sci.osaka-u.ac.jp, Yuki Mitsuta1 mitsutay13@chem.sci.osaka-u.ac.jp, Mitsutaka Okumura1 ok@chem.sci.osaka-u.ac.jp, Shusuke Yamanaka1 syama@chem.sci.osaka-u.ac.jp
Publikováno v:
International Journal of Molecular Sciences. Nov2016, Vol. 17 Issue 11, following p1779. 43p. 8 Diagrams, 19 Charts, 9 Graphs.
Publikováno v:
International Journal of Molecular Sciences; Volume 17; Issue 11; Pages: 1779
International Journal of Molecular Sciences, Vol 17, Iss 11, p 1779 (2016)
International Journal of Molecular Sciences
International Journal of Molecular Sciences, Vol 17, Iss 11, p 1779 (2016)
International Journal of Molecular Sciences
We present the linear response function of bond-orders (LRF-BO) based on a real space integration scheme for molecular systems. As in the case of the LRF of density, the LRF-BO is defined as the response of the bond order of the molecule for the virt
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::7ec8ad66e8a84463e6411001bce6671b