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doi: 10.5281/zenodo.7962087 , 10.5281/zenodo.7886166 , 10.5281/zenodo.7696470 , 10.5281/zenodo.7248083 , 10.5281/zenodo.8221467 , 10.5281/zenodo.10640778 , 10.5281/zenodo.7661228 , 10.5281/zenodo.8131985 , 10.5281/zenodo.7664125 , 10.5281/zenodo.8406254 , 10.5281/zenodo.7442619 , 10.5281/zenodo.10535442
doi: 10.5281/zenodo.7962087 , 10.5281/zenodo.7886166 , 10.5281/zenodo.7696470 , 10.5281/zenodo.7248083 , 10.5281/zenodo.8221467 , 10.5281/zenodo.10640778 , 10.5281/zenodo.7661228 , 10.5281/zenodo.8131985 , 10.5281/zenodo.7664125 , 10.5281/zenodo.8406254 , 10.5281/zenodo.7442619 , 10.5281/zenodo.10535442
New features Add GGA functionals! Add internal PBE, PBEsol, and Chachiyo functionals Option to use all GGAs from Libxc using pylibxc or PySCF Miscellaneous Add Thomas-Fermi and von Weizsäcker kinetic energy density functions Rewrite functionals for better readability Fix Torch operators in some edge cases Merge configuration files in tox.ini Update minimum versions of dependencies
ESP
ESP
| selected citations These citations are derived from selected sources. This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically). | 0 | |
| popularity This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network. | Average | |
| influence This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically). | Average | |
| impulse This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network. | Average |
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