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Investigation of H2, He and atoms and the corresponding diatomic homonuclear molecules of the first row of the periodic table using Gaussian-type Geminal basis sets by means of the CASPT2 method

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  • Austrian Science Fund (FWF)
  • 1 Feb 1999 to 31 Jan 2000

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Project funded by Austrian Science Fund (FWF) (Erwin Schrödinger), research institution: Technische Universität Graz; University of California at San Diego. Approved FWF funding: EUR 29,069, as stated by the source. Runs 1999-02-01 to 2000-01-31 (status: ended). Keywords: ACCURATE QUANTUMCHEMICAL CALCULATIONS, LARGE CHEMICAL SYSTEMS, GAUSSIAN-TYPE GEMINALS, CASPT2, ELECTRON CORRELATION, BASIS SETS. Source: FWF Research Radar (FWF Open API) (national funding data, not CORDIS); selected because its keywords name quantum technology.

Original source.

Source: FWF Research Radar (FWF Open API), Austrian Science Fund (FWF). Retrieved 2026-11-04. Licence: CC0 1.0 (FWF Open API data). Selected metadata, adapted presentation; the publisher's record is authoritative. No endorsement by the source is implied. Licence: public domain dedication (CC0 1.0).

AI-assisted summary: The project, funded by the Austrian Science Fund, investigated H2, He, and diatomic homonuclear molecules using Gaussian-type Geminal basis sets and the CASPT2 method. It was conducted by Technische Universität Graz and the University of California at San Diego from 1999 to 2000. Suggested technology pillar: simulation. Generated by AI from the public source text; it may contain errors and the original source is authoritative.

Source: fwf.ac.at · checked 4 Nov 2026 · AI-assisted summary