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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 9-Jun-2023 | /HFIP_FES/HFIP hfip2_sp | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RMN15 | GENECP | -1579.0209923; Eh | |||
 | 9-Jun-2023 | /DCM_FES/G_AuIPrpropyne AuIPrpropyne_sp_dcm | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RMN15 | GENECP | -1411.0605785; Eh | |||
 | 9-Jun-2023 | /HFIP_FES/propyne propyne_sp | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RMN15 | GENECP | -116.544726; Eh | |||
 | 9-Jun-2023 | /DCM_FES/propyne propyne_sp_dcm | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RMN15 | GENECP | -116.5511972; Eh | |||
 | 9-Jun-2023 | /HFIP_FES/A_AuClIPr+propyne AuClIPr+propyne_sp_hfip | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RMN15 | GENECP | -1871.3536297; Eh | |||
 | 9-Jun-2023 | /HFIP_FES/C_AuClIPr_HFIP AuClIPr_HFIP_sp_hfip | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RMN15 | GENECP | -2544.3218745; Eh | |||
 | 9-Jun-2023 | /HFIP_FES/HFIP hfip3_sp | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RMN15 | GENECP | -2368.5392134; Eh | |||
 | 9-Jun-2023 | /HFIP_FES/B_AuIPrpropyne+Cl AuIPrpropyne+Cl_sp_hfip | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RMN15 | GENECP | -1871.3331698; Eh | |||
 | 9-Jun-2023 | /HFIP_FES/1_AuClIPr AuClIPr_sp | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RMN15 | GENECP | -1754.7965997; Eh | |||
 | 9-Jun-2023 | /DCM_FES/A_AuClIPr+propyne AuClIPr+propyne_sp_dcm | Nelson, David | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RMN15 | GENECP | -1871.3782555; Eh |
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