3_Singlet_Fission_Candidates_pruned_adiabatic.zip
3_Singlet_Fission_Candidates_pruned_adiabatic
.DS_Store
8.2 kB
.ipynb_checkpoints
GS_relaxation
8cc4fc6c13e9b87781eaaa265d48da46_pysis_conv.log
2.2 MB
8cc4fc6c13e9b87781eaaa265d48da46_pysis_conv_relaxed.xyz
2.3 kB
c26e78205536258ed45f30600eb28f89_pysis_conv.log
445.9 kB
c26e78205536258ed45f30600eb28f89_pysis_conv_relaxed.xyz
1.8 kB
d88c89d8a985eb4485725cac3465fb1e_pysis_conv.log
529.7 kB
d88c89d8a985eb4485725cac3465fb1e_pysis_conv_relaxed.xyz
1.5 kB
e5c2ca1e0e0b71a759d340cd585b1b63_pysis_conv.log
1.1 MB
e5c2ca1e0e0b71a759d340cd585b1b63_pysis_conv_relaxed.xyz
2.2 kB
e82572f7cacf695ee43e56b5ca174a39_pysis_conv.log
706.1 kB
e82572f7cacf695ee43e56b5ca174a39_pysis_conv_relaxed.xyz
1.5 kB
READ_ME.txt
298 Bytes
adiabatic_S1
.DS_Store
6.1 kB
8cc4fc6c13e9b87781eaaa265d48da46_pysis_conv.log
1.3 MB
8cc4fc6c13e9b87781eaaa265d48da46_pysis_conv.xyz
1.8 kB
8cc4fc6c13e9b87781eaaa265d48da46_pysis_conv_relaxed.xyz
2.3 kB
c26e78205536258ed45f30600eb28f89_pysis_conv.log
577.4 kB
c26e78205536258ed45f30600eb28f89_pysis_conv.xyz
1.4 kB
c26e78205536258ed45f30600eb28f89_pysis_conv_relaxed.xyz
1.8 kB
d88c89d8a985eb4485725cac3465fb1e_pysis_conv.log
823.1 kB
d88c89d8a985eb4485725cac3465fb1e_pysis_conv.xyz
1.2 kB
d88c89d8a985eb4485725cac3465fb1e_pysis_conv_relaxed.xyz
1.5 kB
e5c2ca1e0e0b71a759d340cd585b1b63_pysis_conv.log
1.2 MB
e5c2ca1e0e0b71a759d340cd585b1b63_pysis_conv.xyz
1.8 kB
e5c2ca1e0e0b71a759d340cd585b1b63_pysis_conv_relaxed.xyz
2.2 kB
e82572f7cacf695ee43e56b5ca174a39_pysis_conv.log
1.3 MB
e82572f7cacf695ee43e56b5ca174a39_pysis_conv.xyz
1.2 kB
e82572f7cacf695ee43e56b5ca174a39_pysis_conv_relaxed.xyz
1.5 kB
e9ec25282d4b5b528c499a999dd9d66d_pysis_conv.log
1.5 MB
e9ec25282d4b5b528c499a999dd9d66d_pysis_conv.xyz
1.3 kB
e9ec25282d4b5b528c499a999dd9d66d_pysis_conv_relaxed.xyz
1.7 kB
adiabatic_T1
8cc4fc6c13e9b87781eaaa265d48da46_pysis_conv.log
1.4 MB
8cc4fc6c13e9b87781eaaa265d48da46_pysis_conv.xyz
1.8 kB
8cc4fc6c13e9b87781eaaa265d48da46_pysis_conv_relaxed.xyz
2.3 kB
c26e78205536258ed45f30600eb28f89_pysis_conv.log
1.4 MB
c26e78205536258ed45f30600eb28f89_pysis_conv.xyz
1.4 kB
c26e78205536258ed45f30600eb28f89_pysis_conv_relaxed.xyz
1.8 kB
d88c89d8a985eb4485725cac3465fb1e_pysis_conv.log
1.7 MB
d88c89d8a985eb4485725cac3465fb1e_pysis_conv.xyz
1.2 kB
d88c89d8a985eb4485725cac3465fb1e_pysis_conv_relaxed.xyz
1.5 kB
e5c2ca1e0e0b71a759d340cd585b1b63_pysis_conv.log
2.0 MB
e5c2ca1e0e0b71a759d340cd585b1b63_pysis_conv.xyz
1.8 kB
e5c2ca1e0e0b71a759d340cd585b1b63_pysis_conv_relaxed.xyz
2.2 kB
e82572f7cacf695ee43e56b5ca174a39_pysis_conv.log
1.0 MB
e82572f7cacf695ee43e56b5ca174a39_pysis_conv.xyz
1.2 kB
e82572f7cacf695ee43e56b5ca174a39_pysis_conv_relaxed.xyz
1.5 kB
e9ec25282d4b5b528c499a999dd9d66d_pysis_conv.log
2.4 MB
e9ec25282d4b5b528c499a999dd9d66d_pysis_conv.xyz
1.3 kB
e9ec25282d4b5b528c499a999dd9d66d_pysis_conv_relaxed.xyz
1.7 kB
vertical
8cc4fc6c13e9b87781eaaa265d48da46_pysis_conv_relaxed.log
6.7 MB
8cc4fc6c13e9b87781eaaa265d48da46_pysis_conv_relaxed.xyz
2.3 kB
c26e78205536258ed45f30600eb28f89_pysis_conv_relaxed.log
6.0 MB
c26e78205536258ed45f30600eb28f89_pysis_conv_relaxed.xyz
1.8 kB
d88c89d8a985eb4485725cac3465fb1e_pysis_conv_relaxed.log
3.2 MB
d88c89d8a985eb4485725cac3465fb1e_pysis_conv_relaxed.xyz
1.5 kB
e5c2ca1e0e0b71a759d340cd585b1b63_pysis_conv_relaxed.log
5.7 MB
e5c2ca1e0e0b71a759d340cd585b1b63_pysis_conv_relaxed.xyz
2.2 kB
e82572f7cacf695ee43e56b5ca174a39_pysis_conv_relaxed.log
2.4 MB
e82572f7cacf695ee43e56b5ca174a39_pysis_conv_relaxed.xyz
1.5 kB
__MACOSX
3_Singlet_Fission_Candidates_pruned_adiabatic
._.DS_Store
120 Bytes
._READ_ME.txt
548 Bytes
adiabatic_S1
._.DS_Store
120 Bytes