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Qualitative potential energy surfaces. 2. Cycloadditions

✍ Scribed by Epiotis, N. D.; Shaik, S.

Book ID: 120341393
Publisher: American Chemical Society
Year: 1978
Tongue: English
Weight: 727 KB
Volume: 100
Category: Article
ISSN: 0002-7863
DOI: 10.1021/ja00469a002

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📜 SIMILAR VOLUMES

Qualitative potential energy surfaces. 1

Qualitative potential energy surfaces. 1. Theory

✍ Epiotis, N. D.; Shaik, S. 📂 Article 📅 1978 🏛 American Chemical Society 🌐 English ⚖ 851 KB

Qualitative potential energy surfaces. 5

Qualitative potential energy surfaces. 5. Sigmatropic shifts

✍ Epiotis, N. D.; Shaik, S. 📂 Article 📅 1977 🏛 American Chemical Society 🌐 English ⚖ 837 KB

Qualitative potential energy surfaces. 4

Qualitative potential energy surfaces. 4. Aromatic substitution

✍ Epiotis, N. D.; Shaik, S. 📂 Article 📅 1978 🏛 American Chemical Society 🌐 English ⚖ 572 KB

Potential energy surfaces of cycloadditi

Potential energy surfaces of cycloaddition reactions

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Potential energy surfaces of HgH2

✍ Anne Bernier; Philippe Millié 📂 Article 📅 1987 🏛 Elsevier Science 🌐 English ⚖ 476 KB

Potential energy surfaces for HgHz have been calculated using a nonempirical relativistic effective core potential incorporating configuration interaction by means of the CIPSI algorithm. Core valence polarization and correlation energy are included via a perturbative treatment. Spin-orbit coupling

Potential energy surfaces for OsH2

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