File:Ab initio calculated energy profiles of CuF3 in the ground and lowest excited states as a function of the angle F-Cu-F.png

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English: Ab initio calculated energy profiles of CuF3 in the ground and lowest excited states as a function of the angle F-Cu-F, typical for this class of electronic e2 configurations, showing the formation of two equilibrium geometries by the PJTE on two excited states, one of which is undistorted, but magnetic, the other being distorted, but nonmagnetic
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Author BorisBella

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12 February 2012

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current20:07, 23 January 2017Thumbnail for version as of 20:07, 23 January 2017456 × 395 (58 KB)BorisBellaUser created page with UploadWizard
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