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Large-scale DFT
calculations of multi-component glass systems (SiO2)0.70(Al2O3)0.13(XO)0.17 (X = Mg, Ca, Sr, Ba) : Accuracy of classical force fields
Large-scale DFT calculations of multi-component glass systems (SiO2)0.70(Al2O3)0.13(XO)0.17 (X = Mg, Ca, Sr, Ba) : Accuracy of classical force fields
Digital
文書・図像類
Atsushi Tanaka, Atsuki Saito, Takashi Murata, Ayako Nakata, Tsuyoshi Miyazaki
Elsevier BV
2023-11-25
Journal of Non-Crystalline Solids
625
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Subject Heading
...s calculations
Large-scale DFT
Classical force fields Molecu...
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