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Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
---|---|---|---|---|---|---|---|---|---|---|---|
22-May-2018 | /1-phenylphospholane_oxide_+_Theosilane_in_THF I1_Theosilane | Fianchini, Mauro | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization Minimum | RM062X | - | -1556.37655723; Eh | ||||
22-May-2018 | /1-phenylphospholane_oxide_+_Theosilane_in_THF Theosilanol | Fianchini, Mauro | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization Minimum | RM062X | - | -826.183638087; Eh | ||||
22-May-2018 | /1-phenylphospholane_oxide_+_H3SiPh_in_toluene I2a_H3SiPh | Fianchini, Mauro | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization Minimum | RM062X | - | -1328.40538715; Eh | ||||
22-May-2018 | /1-phenylphospholane_oxide_+_H3SiPh_in_toluene I1a_H3SiPh | Fianchini, Mauro | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization Minimum | RM062X | - | -1328.39694280; Eh | ||||
22-May-2018 | /1-phenylphospholane_oxide_+_H3SiPh_in_toluene T1d_H3SiPh | Fianchini, Mauro | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization TS | RM062X | - | -1328.37481881; Eh | ||||
22-May-2018 | /1-phenylphospholane_oxide_+_H3SiPh_in_toluene T1f_H3SiPh | Fianchini, Mauro | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization TS | RM062X | - | -1328.37030007; Eh | ||||
22-May-2018 | /1-phenylphospholane_oxide_+_H3SiPh_in_toluene T1e_H3SiPh | Fianchini, Mauro | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization TS | RM062X | - | -1328.37450409; Eh | ||||
22-May-2018 | /1-phenylphospholane_oxide_+_H3SiPh_in_toluene T1c_H3SiPh | Fianchini, Mauro | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization TS | RM062X | - | -1328.37452428; Eh | ||||
22-May-2018 | /1-phenylphospholane_oxide_+_H3SiPh_in_toluene T6a_H2HOSiPh | Fianchini, Mauro | Gaussian; 09; EM64L-G09RevD.01 | Single point Structure | RM062X | - | -1403.67680166; Eh | ||||
22-May-2018 | /1-phenylphospholane_oxide_+_H3SiPh_in_toluene T4a_H2HOSiPh | Fianchini, Mauro | Gaussian; 09; EM64L-G09RevD.01 | Geometry optimization TS | RM062X | - | -1403.67988937; Eh |
Results 61-70 of 343 (Search time: 0.001 seconds).