✦ LIBER ✦

Calculation of the electronic spectrum of formaldehyde

✍ Scribed by S.D. Peyerimhoff; R.J. Buenker; W.E. Kammer; H. Hsu

Publisher: Elsevier Science
Year: 1971
Tongue: English
Weight: 792 KB
Volume: 8
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(71)80596-1

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Calculations on the electronic spectrum

Calculations on the electronic spectrum of water

✍ Robert J. Buenker; Sigrid D. Peyerimhoff 📂 Article 📅 1974 🏛 Elsevier Science 🌐 English ⚖ 731 KB

Ab initio SCF and CI calculations are reported for excitetion energies, oscillator strengths and geometry of , upper states in the low-energy electronic transitions of water. Good agreement is obtained with experimental data where available, both with regard to the location and intensity of the mric

Non-empirical calculations on the electr

Non-empirical calculations on the electronic spectrum of butadiene

✍ Shingkuo Shih; Robert J. Buenker; Sigrid D. Peyerimhoff 📂 Article 📅 1972 🏛 Elsevier Science 🌐 English ⚖ 713 KB

Approximation methods for all-electron c

Approximation methods for all-electron calculations. The formaldehyde molecule

✍ D.B. Cook; R. McWeeny 📂 Article 📅 1968 🏛 Elsevier Science 🌐 English ⚖ 269 KB

The electronic spectrum of benzene

✍ J. Karwowski 📂 Article 📅 1973 🏛 Elsevier Science 🌐 English ⚖ 383 KB

The Ground State Rotational Spectrum of

The Ground State Rotational Spectrum of Formaldehyde

✍ R. Bocquet; J. Demaison; L. Poteau; M. Liedtke; S. Belov; K.M.T. Yamada; G. Winn 📂 Article 📅 1996 🏛 Elsevier Science 🌐 English ⚖ 335 KB

The ground state rotational spectrum has been measured from 1 to 2600 GHz. These new measurements together with the older ones have been fitted to a standard A-reduced Watson-type Hamiltonian. The accuracy of the rotational and centrifugal distortion (including some octic ones) constants has been no

The electronic spectrum of Cr2

✍ K. Andersson 📂 Article 📅 1995 🏛 Elsevier Science 🌐 English ⚖ 783 KB

The electronic spectrum of Cr 2 has been studied using multiconfigurational second-order perturbation theory. Potential curves for 18 electronic states have been computed. By employing an atomic natural orbital (ANO) basis set of the size 8s7p6d4f and by including 3s3p correlation effects and relati