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kohn-sham_random-phase_approximation [2023/08/13 20:11] – [RIRPA program] chemieegortrushi | kohn-sham_random-phase_approximation [2024/03/26 08:17] (current) – external edit 127.0.0.1 | ||
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{cfit, | {cfit, | ||
- | acfd;rirpa ! RPA/σ-functional calculation; | + | acfd;rirpa ! RPA/sigma-functional calculation; |
</ | </ | ||
As well as an example of spin-unrestricted calculation for the NH< | As well as an example of spin-unrestricted calculation for the NH< | ||
Line 369: | Line 369: | ||
{cfit, | {cfit, | ||
- | acfd;urirpa ! RPA/σ-functional calculation; | + | acfd;urirpa ! RPA/sigma-functional calculation; |
</ | </ | ||
The following options are available for the RIRPA and URIRPA programs:\\ | The following options are available for the RIRPA and URIRPA programs:\\ |