Browsing by Author Curti, Mariano
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Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
---|---|---|---|---|---|---|---|---|---|---|---|
![]() | 14-Feb-2023 | alpha2_parallel-antiparallel_md0 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -171.45929740416; Eh | |||
![]() | 14-Feb-2023 | alpha2_parallel-antiparallel_md1 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -171.5031913632; Eh | |||
![]() | 14-Feb-2023 | alpha2_parallel-antiparallel_md10 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -171.46469365247998; Eh | |||
![]() | 14-Feb-2023 | alpha2_parallel-antiparallel_md11 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -171.50754220992; Eh | |||
![]() | 14-Feb-2023 | alpha2_parallel-antiparallel_md2 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -171.4639521504; Eh | |||
![]() | 14-Feb-2023 | alpha2_parallel-antiparallel_md3 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -171.47093913024; Eh | |||
![]() | 14-Feb-2023 | alpha2_parallel-antiparallel_md4 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -171.5013260544; Eh | |||
![]() | 14-Feb-2023 | alpha2_parallel-antiparallel_md5 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -171.51866872512; Eh | |||
![]() | 14-Feb-2023 | alpha2_parallel-antiparallel_md6 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -171.4686213984; Eh | |||
![]() | 14-Feb-2023 | alpha2_parallel-antiparallel_md7 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -171.47955174144; Eh | |||
![]() | 14-Feb-2023 | alpha2_parallel-antiparallel_md8 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -171.4498989888; Eh | |||
![]() | 14-Feb-2023 | alpha2_parallel-antiparallel_md9 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -171.47448441216; Eh | |||
![]() | 14-Feb-2023 | alpha4_antiparallel_1chrom_md0 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -167.77932154367997; Eh | |||
![]() | 14-Feb-2023 | alpha4_antiparallel_1chrom_md1 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -167.79355207296; Eh | |||
![]() | 14-Feb-2023 | alpha4_antiparallel_1chrom_md10 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -167.80582167743998; Eh | |||
![]() | 14-Feb-2023 | alpha4_antiparallel_1chrom_md11 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -167.78708635968; Eh | |||
![]() | 14-Feb-2023 | alpha4_antiparallel_1chrom_md2 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -167.78909636736; Eh | |||
![]() | 14-Feb-2023 | alpha4_antiparallel_1chrom_md3 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -167.79652668672; Eh | |||
![]() | 14-Feb-2023 | alpha4_antiparallel_1chrom_md4 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -167.806330992; Eh | |||
![]() | 14-Feb-2023 | alpha4_antiparallel_1chrom_md5 | Curti, Mariano | Amber; 18 | Molecular Dynamics | - | - | -167.820410448; Eh |