1 to 10 of 63 Results
Oct 19, 2022 -
Data supporting Mixed-anion mixed-cation perovskite (FAPbI3)0.875(MAPbBr3)0.125: an ab initio molecular dynamics study
application/x-bzip2 - 34.7 MB - MD5: 50773c8957d185a9d1998e5c09ff5d23
Velocities of molecular dynamics simulation of FAPI. Time interval: 12-16 ps. |
Nov 22, 2021 -
Molecular dynamics of halide perovskite alloys
application/x-bzip2 - 1.5 MB - MD5: a003c532ee36729cd9a1486d467994b6
Molecular dynamics data of FAPbBr3. |
Nov 22, 2021 -
Molecular dynamics of halide perovskite alloys
application/x-bzip2 - 150.0 MB - MD5: c9b7193f5bd70a40946539b1085e3aaa
Molecular dynamics positions of FaPbBr3. |
Nov 22, 2021 -
Molecular dynamics of halide perovskite alloys
application/x-bzip2 - 104.4 MB - MD5: 36c2f28eb20291bdd367d369471ea609
Molecular dynamics velocities of FaPbBr3. |
Nov 22, 2021 -
Molecular dynamics of halide perovskite alloys
application/x-bzip2 - 1.5 MB - MD5: 7eb63288dc1783cd21e4417280f08feb
Molecular dynamics data of of (FAPbI3)0.875-(CsPbBr3)0.125. Equilibrated stage is in directory Production for steps > 6000.
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Nov 22, 2021 -
Molecular dynamics of halide perovskite alloys
application/x-bzip2 - 46.3 MB - MD5: 0631bc56cc937ddb45fa6785c2240d66
MD coordinates of (FAPbI3)0.875-(CsPbBr3)0.125. 10020 fs to 14020 fs. |
Nov 22, 2021 -
Molecular dynamics of halide perovskite alloys
application/x-bzip2 - 23.4 MB - MD5: b204e05ecaa055ec1c1fba0f19b97e1a
MD coordinates of (FAPbI3)0.875-(CsPbBr3)0.125. 4001 fs to 6020 fs. This is the last part of equilibration stage. |
Nov 22, 2021 -
Molecular dynamics of halide perovskite alloys
application/x-bzip2 - 46.3 MB - MD5: 767cac968c176c2f8f885318746a2cf5
MD coordinates of (FAPbI3)0.875-(CsPbBr3)0.125. 6021 fs to 10020 fs. |
Nov 22, 2021 -
Molecular dynamics of halide perovskite alloys
application/x-bzip2 - 32.1 MB - MD5: 2f66f05e607ea3662759d0f579f5bfed
MD velocities of (FAPbI3)0.875-(CsPbBr3)0.125. 10021 fs to 14020 fs. |
Nov 22, 2021 -
Molecular dynamics of halide perovskite alloys
application/x-bzip2 - 16.2 MB - MD5: 4fd68b6fd71831874ebefff2a5e15410
MD velocities of (FAPbI3)0.875-(CsPbBr3)0.125. 4001 fs to 6020 fs. |