公開日期 | 標題 | 作者 | 來源出版物 | scopus | WOS | 全文 |
2020 | Accurate Prediction of Vertical Emission from Excited-State Tuning of Range-Separated Density Functional Theory | Vikramaditya, T.; Lin, S.-T.; SHIANG-TAI LIN | Journal of Physical Chemistry C | | 6 | |
2017 | Assessing the role of Hartree-Fock exchange, correlation energy and long range corrections in evaluating ionization potential, and electron affinity in density functional theory | Vikramaditya, T.; Lin, S.-T.; SHIANG-TAI LIN | Journal of Computational Chemistry | | | |
2018 | Impact of non-empirically tuning the range-separation parameter of long-range corrected hybrid functionals on ionization potentials, electron affinities, and fundamental gaps | Vikramaditya, T.; Chai, J.-D.; JENG-DA CHAI ; SHIANG-TAI LIN | Journal of Computational Chemistry | 10 | 10 | |
2019 | Limitations of Global Hybrids in Predicting the Geometries and Torsional Energy Barriers of Dimeric Systems and the Role of Hartree Fock and DFT Exchange | Vikramaditya, T.; Lin, S.-T.; SHIANG-TAI LIN | Journal of Computational Chemistry | | | |