화학공학소재연구정보센터
검색결과 : 3건
No. Article
1 A quantum informational approach for dissecting chemical reactions
Duperrouzel C, Tecmer P, Boguslawski K, Barcza G, Legeza O, Ayers PW
Chemical Physics Letters, 621, 160, 2015
2 Assessing the Accuracy of New Geminal-Based Approaches
Tecmer P, Boguslawski K, Johnson PA, Limacher PA, Chan M, Verstraelen T, Ayers PW
Journal of Physical Chemistry A, 118(39), 9058, 2014
3 Charge-Transfer Excitations in Uranyl Tetrachloride ([UO2Cl4](2-)): How Reliable are Electronic Spectra from Relativistic Time-Dependent Density Functional Theory?
Tecmer P, Bast R, Ruud K, Visscher L
Journal of Physical Chemistry A, 116(27), 7397, 2012