Hjalmars in Stockholm über die "zero differential overlap"-Näherung, die in der damals dominierenden semi-empirischen Quantenchemie eine wichtige Rolle spielte. Er war als Postdoktorand ein Jahr in der Gruppe von Enrico Clementi am IBM Research Institute in San Jose (USA), wo er in die relativ neue
Björn O. Roos (1937–2010)
✍ Scribed by Werner Kutzelnigg
- Publisher
- John Wiley and Sons
- Year
- 2010
- Tongue
- English
- Weight
- 153 KB
- Volume
- 49
- Category
- Article
- ISSN
- 0044-8249
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✦ Synopsis
graduated in 1968 as a student of Inga Fischer-Hjalmars in Stockholm on the "zero differential overlap" approximation, which played a key role in the then dominating semi-empirical quantum chemistry. He spent a year as a postdoc in the group of Enrico Clementi at the IBM Research Institute in San Jose (USA), where he was initiated to the rapidly developing field of numerical ab-initio quantum chemistry.
Roos first important contribution to quantum chemistry has, in 1972, been the method known now as "direct CI". Unlike to what used to be common in
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