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Collection's Items (Sorted by Submit Date in Descending order): 361 to 380 of 6276
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 24-Mar-2025 | Cyphenothrin_RS_CONF19_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31831976; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RS_CONF2_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31690159; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RS_CONF20_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31817134; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RS_CONF21_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31819328; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RS_CONF218_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31273422; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RS_CONF22_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31772454; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RS_CONF23_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31791084; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RS_CONF24_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31781795; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RS_CONF25_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31897435; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RS_CONF27_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31763993; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RS_CONF28_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31759709; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RS_CONF29_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31836216; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RS_CONF3_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31738652; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RS_CONF34_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31795391; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RS_CONF36_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31729357; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RS_CONF37_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31751186; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RS_CONF38_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31825435; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RS_CONF39_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31741148; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RS_CONF4_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31857583; Eh | |||
 | 24-Mar-2025 | Cyphenothrin_RS_CONF40_water | Pulgar Rubio, Antonio | Orca; 5.0.2; RELEASE | Single point | DFT | def2-TZVPP; def2/J; cpcm | -1285.31741480; Eh |
Collection's Items (Sorted by Submit Date in Descending order): 361 to 380 of 6276
