MD simulations Phase IV-V H2

Magdau, Ioan-Bogdan; Borgulya, Balint; Tyson, Benjamin
URI: http://localhost:8080/xmlui/handle/CUHPOERS/243846

Description:

Data supporting the thesis "Theoretical investigation of solid hydrogen and deuterium" Magdau, Ioan-Bogdan (2016) [PhD thesis].

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alldata.lattice 487.7Kb application/octet-stream View/Open
ca.sh 855bytes text/plain View/Open
Pbcn_200GPa.castep 25.67Mb application/octet-stream View/Open
Pbcn_200GPa.cell 25.03Kb application/octet-stream View/Open
Pbcn_200GPa.lattice 44.63Kb application/octet-stream View/Open
Pbcn_200GPa.param 789bytes application/octet-stream View/Open
Pbcn_200GPa.png 3.136Mb image/png View/Open
Pbcn_200GPa-out.cell 25.06Kb application/octet-stream View/Open
Pbcn_250GPa.castep 25.69Mb application/octet-stream View/Open
Pbcn_250GPa.cell 25.03Kb application/octet-stream View/Open
Pbcn_250GPa.lattice 44.63Kb application/octet-stream View/Open
Pbcn_250GPa.param 789bytes application/octet-stream View/Open
Pbcn_250GPa.png 4.132Mb image/png View/Open
Pbcn_250GPa-out.cell 25.06Kb application/octet-stream View/Open
Pbcn_275GPa.castep 25.69Mb application/octet-stream View/Open
Pbcn_275GPa.cell 25.06Kb application/octet-stream View/Open
Pbcn_275GPa.lattice 44.63Kb application/octet-stream View/Open
Pbcn_275GPa.param 789bytes application/octet-stream View/Open
Pbcn_275GPa.png 4.460Mb image/png View/Open
Pbcn_275GPa-out.cell 25.06Kb application/octet-stream View/Open
Pbcn_300GPa.castep 25.70Mb application/octet-stream View/Open
Pbcn_300GPa.cell 25.03Kb application/octet-stream View/Open
Pbcn_300GPa.lattice 44.60Kb application/octet-stream View/Open
Pbcn_300GPa.param 789bytes application/octet-stream View/Open
Pbcn_300GPa.png 4.339Mb image/png View/Open
Pbcn_300GPa-out.cell 25.06Kb application/octet-stream View/Open
Pbcn_325GPa.castep 25.74Mb application/octet-stream View/Open
Pbcn_325GPa.cell 25.06Kb application/octet-stream View/Open
Pbcn_325GPa.lattice 44.39Kb application/octet-stream View/Open
Pbcn_325GPa.param 789bytes application/octet-stream View/Open
Pbcn_325GPa.png 4.389Mb image/png View/Open
Pbcn_325GPa-out.cell 25.06Kb application/octet-stream View/Open
Pbcn_350GPa.castep 25.76Mb application/octet-stream View/Open
Pbcn_350GPa.cell 25.03Kb application/octet-stream View/Open
Pbcn_350GPa.lattice 44.13Kb application/octet-stream View/Open
Pbcn_350GPa.param 789bytes application/octet-stream View/Open
Pbcn_350GPa.png 4.747Mb image/png View/Open
Pbcn_350GPa-out.cell 25.06Kb application/octet-stream View/Open
Pbcn_375GPa.castep 25.80Mb application/octet-stream View/Open
Pbcn_375GPa.cell 25.06Kb application/octet-stream View/Open
Pbcn_375GPa.lattice 44.13Kb application/octet-stream View/Open
Pbcn_375GPa.param 789bytes application/octet-stream View/Open
Pbcn_375GPa.png 4.646Mb image/png View/Open
Pbcn_375GPa-out.cell 25.06Kb application/octet-stream View/Open
Pbcn_400GPa.castep 25.82Mb application/octet-stream View/Open
Pbcn_400GPa.cell 25.03Kb application/octet-stream View/Open
Pbcn_400GPa.lattice 44.13Kb application/octet-stream View/Open
Pbcn_400GPa.param 789bytes application/octet-stream View/Open
Pbcn_400GPa.png 4.116Mb image/png View/Open
Pbcn_400GPa-out.cell 25.06Kb application/octet-stream View/Open
Pbcn_425GPa.castep 25.85Mb application/octet-stream View/Open
Pbcn_425GPa.cell 25.06Kb application/octet-stream View/Open
Pbcn_425GPa.lattice 44.13Kb application/octet-stream View/Open
Pbcn_425GPa.param 789bytes application/octet-stream View/Open
Pbcn_425GPa.png 3.793Mb image/png View/Open
Pbcn_425GPa-out.cell 25.06Kb application/octet-stream View/Open
Pbcn_450GPa.castep 25.88Mb application/octet-stream View/Open
Pbcn_450GPa.cell 25.03Kb application/octet-stream View/Open
Pbcn_450GPa.lattice 44.13Kb application/octet-stream View/Open
Pbcn_450GPa.param 789bytes application/octet-stream View/Open
Pbcn_450GPa.png 4.501Mb image/png View/Open
Pbcn_450GPa-out.cell 25.06Kb application/octet-stream View/Open
Pbcn_500GPa.castep 25.95Mb application/octet-stream View/Open
Pbcn_500GPa.cell 25.03Kb application/octet-stream View/Open
Pbcn_500GPa.lattice 44.13Kb application/octet-stream View/Open
Pbcn_500GPa.param 789bytes application/octet-stream View/Open
Pbcn_500GPa.png 3.120Mb image/png View/Open
Pbcn_500GPa-out.cell 25.06Kb application/octet-stream View/Open

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