Structural transitions of calcium carbonate by molecular dynamics simulation

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Calcium carbonate (CaCO₃) plays a crucial role in the global carbon cycle, and its phase diagram is of significant scientific interest. We used molecular dynamics to investigate...

Structural transitions of calcium carbonate by molecular dynamics simulation

Calcium carbonate (CaCO₃) plays a crucial role in the global carbon cycle, and its phase diagram is of significant scientific interest. We used molecular dynamics to investigate selected structural ph

DataCite Commons2026-03-12 更新00

Structural transitions of calcium carbonate by molecular dynamics simulation

DataCite Commons2026-03-12 更新20

Structural transitions of calcium carbonates in the lower mantle

Metal carbonates MCO3 (M=Ca,Mg,Fe,Sr) are among of the most common minerals and contain ≈ 60–70% of the inorganic carbon present on Earth’s surface and in its crust[1]. Carbonates play important role

DataCite Commons2026-03-09 更新00

Structural transitions of calcium carbonate by molecular dynamics simulation

Calcium carbonate (CaCO₃) plays a crucial role in the global carbon cycle, and its phase diagram is of significant scientific interest. We used molecular dynamics to investigate...

B2FIND00

Structural transitions of calcium carbonate by molecular dynamics simulation

DataCite Commons2026-03-12 更新20