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Collection's Items (Sorted by Submit Date in Descending order): 2041 to 2060 of 6872
| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 28-Mar-2025 | ipconazole_RSR_CONF17_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.14416079; Eh | |||
 | 28-Mar-2025 | ipconazole_RSR_CONF172_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.14071057; Eh | |||
 | 28-Mar-2025 | ipconazole_RSR_CONF18_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.14409262; Eh | |||
 | 28-Mar-2025 | ipconazole_RSR_CONF184_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.14081530; Eh | |||
 | 28-Mar-2025 | ipconazole_RSR_CONF2_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.14237724; Eh | |||
 | 28-Mar-2025 | ipconazole_RSR_CONF24_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.14269597; Eh | |||
 | 28-Mar-2025 | ipconazole_RSR_CONF247_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.14089752; Eh | |||
 | 28-Mar-2025 | ipconazole_RSR_CONF250_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.14108160; Eh | |||
 | 28-Mar-2025 | ipconazole_RSR_CONF3_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.14092561; Eh | |||
 | 28-Mar-2025 | ipconazole_RSR_CONF34_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.14347266; Eh | |||
 | 28-Mar-2025 | ipconazole_RSR_CONF35_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.14334324; Eh | |||
 | 28-Mar-2025 | ipconazole_RSR_CONF37_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.14287482; Eh | |||
 | 28-Mar-2025 | ipconazole_RSR_CONF48_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.14161815; Eh | |||
 | 28-Mar-2025 | ipconazole_RSR_CONF55_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.14118604; Eh | |||
 | 28-Mar-2025 | ipconazole_RSR_CONF57_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.14008650; Eh | |||
 | 28-Mar-2025 | ipconazole_RSR_CONF59_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.14096846; Eh | |||
 | 28-Mar-2025 | ipconazole_RSR_CONF63_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.14131919; Eh | |||
 | 28-Mar-2025 | ipconazole_RSR_CONF65_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.13949990; Eh | |||
 | 28-Mar-2025 | ipconazole_RSR_CONF69_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.14235739; Eh | |||
 | 28-Mar-2025 | ipconazole_RSR_CONF7_gas | Pulgar Rubio, Antonio | Orca; 4.2.1; RELEASE | Single point | DFT | def2-TZVPP; def2/J | -1400.14035755; Eh |
Collection's Items (Sorted by Submit Date in Descending order): 2041 to 2060 of 6872
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