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lamaGOET: an interface for quantum crystallography
In quantum crystallography, theoretical calculations and crystallographic refinements are closely intertwined. This means that the employed software must be able to perform both quantum-mechanical calculations and crystallographic least-squares refinements. So far, the program Tonto is the only one...
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| I publikationen: | J Appl Crystallogr |
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| Huvudupphovsmän: | , , |
| Materialtyp: | Artigo |
| Språk: | Inglês |
| Publicerad: |
International Union of Crystallography
2021
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| Ämnen: | |
| Länkar: | https://ncbi.nlm.nih.gov/pmc/articles/PMC8202027/ https://ncbi.nlm.nih.gov/pubmed/34188618 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1107/S1600576721002545 |
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