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101 a 110 de 186 Resultados

MAPBr-pos-1-18001-22000.xyz.bz2 19 nov. 2021 - Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study Archivo Bzip - 50.0 MB - MD5: 6dc792f91f89852c1153daaac0360b60 Coordinates of molecular dynamics of MAPbBr3. Time interval: 18-22ps.
MAPBr-pos-1-22001-26000.xyz.bz2 19 nov. 2021 - Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study Archivo Bzip - 50.0 MB - MD5: 3dd72a304209301c3aa805a95d96c199 Coordinates of molecular dynamics simulation of MAPbBr3. Time interval: 22-26ps.
MAPBr-pos-1-6001-18000.xyz.bz2 19 nov. 2021 - Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study Archivo Bzip - 149.8 MB - MD5: 4dd9341632d64857226be63c16a74ed5 Coordinates of molecular dynamics simulation of MAPbBr3. Time interval: 6-18ps.
MAPBr-statistics-0-26ps.tar.bz2 19 nov. 2021 - Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study Archivo Bzip - 900.1 KB - MD5: dd54d2daa14ced3ac464728d6f431046 Statistics of MD simulation of MAPbBr3. Equilibrated in time interval 6-26ps.
MAPBr-vel-1-18001-22000.xyz.bz2 19 nov. 2021 - Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study Archivo Bzip - 35.0 MB - MD5: bba18b737637bbd5ee46e13989dea9c6 Statistics of MD simulation of MAPbBr3. Equilibrated in time interval 6-26ps.
MAPBr-vel-1-22001-26000.xyz.bz2 19 nov. 2021 - Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study Archivo Bzip - 35.0 MB - MD5: 1133cd8e44579e61200105ce83ee66cf Velocities of molecular dynamics simulation of MAPbBr3. Time interval: 22-26ps.
MAPBr-vel-1.xyz-10001-18000.bz2 19 nov. 2021 - Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study Archivo Bzip - 69.9 MB - MD5: 342aafaf793a31da4804a3e967a6aaae Velocities of molecular dynamics simulation of MAPbBr3. Time interval: 10-18ps.
MAPBr-vel-1.xyz-6001-10000.bz2 19 nov. 2021 - Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study Archivo Bzip - 35.0 MB - MD5: 0662e002e31010149223d94e968b5acf Velocities of molecular dynamics simulation of MAPbBr3. Time interval: 6-10ps.
MAPI-NVT-Nose.tar.bz2 22 nov. 2021 - Molecular dynamics of halide perovskite alloys Bzip Archive - 2.2 MB - MD5: dd94256f59301de936f99ab3bbbe8bc1
MAPI-pos-1.xyz.bz2 22 nov. 2021 - Molecular dynamics of halide perovskite alloys Bzip Archive - 207.7 MB - MD5: e8cf554711b93c58e9eafbffa5967b6b

MAPBr-pos-1-18001-22000.xyz.bz2

19 nov. 2021 - Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study

Archivo Bzip - 50.0 MB -

Coordinates of molecular dynamics of MAPbBr3. Time interval: 18-22ps.

MAPBr-pos-1-22001-26000.xyz.bz2

19 nov. 2021 - Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study

Archivo Bzip - 50.0 MB -

Coordinates of molecular dynamics simulation of MAPbBr3. Time interval: 22-26ps.

MAPBr-pos-1-6001-18000.xyz.bz2

19 nov. 2021 - Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study

Archivo Bzip - 149.8 MB -

Coordinates of molecular dynamics simulation of MAPbBr3. Time interval: 6-18ps.