Computation of rotation matrices making lined-up to the local Cartesian coordinates
Küçük Resim Yok
Tarih
2007
Dergi Başlığı
Dergi ISSN
Cilt Başlığı
Yayıncı
CHINESE CHEMICAL SOC
Erişim Hakkı
info:eu-repo/semantics/closedAccess
Özet
Rotation matrices were expressed in terms of Gaunt coefficients and complex spherical harmonics. The rotation matrices were calculated using two different ways. In the first, Gaunt coefficients and normalized complex spherical harmonics were directly calculated using binomial coefficients; in the second, Gaunt coefficients and complex spherical harmonics were recursively calculated. The methods were compared with respect to accuracy and computation time (CPU) for low and very high quantum numbers.
Açıklama
Anahtar Kelimeler
rotation matrices, gaunt coefficients, spherical harmonics, binomial coefficients
Kaynak
JOURNAL OF THE CHINESE CHEMICAL SOCIETY
WoS Q Değeri
Q3
Scopus Q Değeri
Q3
Cilt
54
Sayı
5
