| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
 | 16-Feb-2026 | /24-38H+_complex/optimisation-frequencies diP-wat-prod_wB97XD_def2svp_SMD-DCM_ener_opt_freq2 | Dell'Amico, Luca; Krishnan, Chandu; Serapian, Stefano A.; Cormier, Gabriel; Bortolus, Marco | Gaussian; 16; ES64L-G16RevC.02 | Geometry optimization Minimum | UwB97XD | DEF2SVP | -1834.67337637; Eh | | | |
 | 16-Feb-2026 | /Int-2-water_complex/optimisation-frequencies diP-wat_wB97XD_def2svp_SMD-DCM_ener_opt_freq | Dell'Amico, Luca; Krishnan, Chandu; Serapian, Stefano A.; Cormier, Gabriel; Bortolus, Marco | Gaussian; 16; ES64L-G16RevC.02 | Geometry optimization Minimum | UwB97XD | DEF2SVP | -1834.64575288; Eh | | | |
 | 18-Feb-2026 | /benzyne_attack_iodobenzene benzyne_attack_iodobenzene_ts_opt | Murphy, John; Tuttle, Tell; Robertson, Craig; Nelson, David; Clark, Kenneth; Tyerman, Seb; Stewart, Alexander; Evans, Laura; Kennedy, Alan; Kolodziejczak, Krystian | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization TS | UM062X | 6-311++G(D,P) SDD GENECP | -473.787578019; Eh | | | |
 | 18-Feb-2026 | /benzyne_attack_benzene/p-benzyne_benzene_ts p-benzyne_benzene_product_sp-s | Murphy, John; Tuttle, Tell; Robertson, Craig; Nelson, David; Clark, Kenneth; Tyerman, Seb; Stewart, Alexander; Evans, Laura; Kennedy, Alan; Kolodziejczak, Krystian | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | UM062X | GENECP | -463.1580645; Eh | | | |
 | 18-Feb-2026 | /benzyne_attack_iodobenzene benzyne_attack_iodobenzene_ts_sp-s | Murphy, John; Tuttle, Tell; Robertson, Craig; Nelson, David; Clark, Kenneth; Tyerman, Seb; Stewart, Alexander; Evans, Laura; Kennedy, Alan; Kolodziejczak, Krystian | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | UM062X | GENECP | -760.143545; Eh | | | |
 | 18-Feb-2026 | /SET bromoanthracene_radical_anion_opt | Murphy, John; Tuttle, Tell; Robertson, Craig; Nelson, David; Clark, Kenneth; Tyerman, Seb; Stewart, Alexander; Evans, Laura; Kennedy, Alan; Kolodziejczak, Krystian | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | UM062X | 6-311++G(D,P) | -3113.06862749; Eh | | | |
 | 18-Feb-2026 | /SET bromoanthracene_radical_anion_sp | Murphy, John; Tuttle, Tell; Robertson, Craig; Nelson, David; Clark, Kenneth; Tyerman, Seb; Stewart, Alexander; Evans, Laura; Kennedy, Alan; Kolodziejczak, Krystian | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | UM062X | GENECP | -3113.2599017; Eh | | | |
 | 18-Feb-2026 | /SET bromoanthracene_sp | Murphy, John; Tuttle, Tell; Robertson, Craig; Nelson, David; Clark, Kenneth; Tyerman, Seb; Stewart, Alexander; Evans, Laura; Kennedy, Alan; Kolodziejczak, Krystian | Gaussian; 16; ES64L-G16RevC.01 | Single point Structure | RM062X | GENECP | -3113.1914674; Eh | | | |
 | 18-Feb-2026 | /Me_rad_reactions/anthracene_attack 9-anthracene_attack_products_opt | Murphy, John; Tuttle, Tell; Robertson, Craig; Nelson, David; Clark, Kenneth; Tyerman, Seb; Stewart, Alexander; Evans, Laura; Kennedy, Alan; Kolodziejczak, Krystian | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | UM062X | 6-311++G(D,P) | -579.307015490; Eh | | | |
 | 18-Feb-2026 | /Me_rad_reactions/anthracene_attack 2-anthracene_attack_products_opt | Murphy, John; Tuttle, Tell; Robertson, Craig; Nelson, David; Clark, Kenneth; Tyerman, Seb; Stewart, Alexander; Evans, Laura; Kennedy, Alan; Kolodziejczak, Krystian | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | UM062X | 6-311++G(D,P) | -579.286327556; Eh | | | |
