Higher Hartree-Fock frequency-dependent hyperpolarizabilities

M. M. Mestechkin; G. E. Whyman

doi:10.1016/0009-2614(92)85648-T

Higher Hartree-Fock frequency-dependent hyperpolarizabilities

M. M. Mestechkin
, G. E. Whyman

نتاج البحث: نشر في مجلة › مقالة › مراجعة النظراء

13 اقتباسات (Scopus)

ملخص

The Dalgarno theorem is generalized in the Hartree-Fock approximation for dynamic hyperpolarizabilities and applied for calculations of the hyperpolarizability describing the fourth harmonic generation and of the benzene second hyperpolarizability. A possible reason for the negative value of the latter obtained in CNDO calculations is discussed.

اللغة الأصلية	الإنجليزيّة
الصفحات (من إلى)	395-398
عدد الصفحات	4
دورية	Chemical Physics Letters
مستوى الصوت	193
رقم الإصدار	5
المعرِّفات الرقمية للأشياء	https://doi.org/10.1016/0009-2614(92)85648-T
حالة النشر	نُشِر - 5 يونيو 1992
منشور خارجيًا	نعم

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10.1016/0009-2614(92)85648-T

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قم بذكر هذا

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title = "Higher Hartree-Fock frequency-dependent hyperpolarizabilities",

abstract = "The Dalgarno theorem is generalized in the Hartree-Fock approximation for dynamic hyperpolarizabilities and applied for calculations of the hyperpolarizability describing the fourth harmonic generation and of the benzene second hyperpolarizability. A possible reason for the negative value of the latter obtained in CNDO calculations is discussed.",

author = "Mestechkin, \{M. M.\} and Whyman, \{G. E.\}",

year = "1992",

month = jun,

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doi = "10.1016/0009-2614(92)85648-T",

language = "אנגלית",

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T1 - Higher Hartree-Fock frequency-dependent hyperpolarizabilities

AU - Mestechkin, M. M.

AU - Whyman, G. E.

PY - 1992/6/5

Y1 - 1992/6/5

N2 - The Dalgarno theorem is generalized in the Hartree-Fock approximation for dynamic hyperpolarizabilities and applied for calculations of the hyperpolarizability describing the fourth harmonic generation and of the benzene second hyperpolarizability. A possible reason for the negative value of the latter obtained in CNDO calculations is discussed.

AB - The Dalgarno theorem is generalized in the Hartree-Fock approximation for dynamic hyperpolarizabilities and applied for calculations of the hyperpolarizability describing the fourth harmonic generation and of the benzene second hyperpolarizability. A possible reason for the negative value of the latter obtained in CNDO calculations is discussed.

UR - https://www.scopus.com/pages/publications/0000778988

U2 - 10.1016/0009-2614(92)85648-T

DO - 10.1016/0009-2614(92)85648-T

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AN - SCOPUS:0000778988

SN - 0009-2614

VL - 193

SP - 395

EP - 398

JO - Chemical Physics Letters

JF - Chemical Physics Letters

IS - 5

ER -

Higher Hartree-Fock frequency-dependent hyperpolarizabilities

ملخص

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