Equation of state of water based on the SCAN meta-GGA density functional
2020 ◽
Vol 22
(8)
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pp. 4626-4631
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Keyword(s):
By ab initio molecular dynamics simulations, the newly developed SCAN meta-GGA functional is proved better than the widely used PBE-GGA functional in describing the equation of state of water.
2020 ◽
Vol 1180
◽
pp. 112821
2018 ◽
Vol 20
(36)
◽
pp. 23717-23725
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2006 ◽
Vol 70
(9)
◽
pp. 2311-2324
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2021 ◽
1996 ◽
Vol 255
(1-3)
◽
pp. 187-194
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2001 ◽
Vol 115
(23)
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pp. 10808-10813
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