화학공학소재연구정보센터
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No. Article
1 Spin-orbit split ionized and electron-attached states using explicitly-correlated equation-of-motion coupled-cluster singles and doubles eigenvectors
Bokhan D, Trubnikov DN, Perera A, Bartlett RJ
Chemical Physics Letters, 730, 372, 2019
2 Spin-orbit splitted excited states using explicitly-correlated equation-of-motion coupled-cluster singles and doubles eigenvectors
Bokhan D, Trubnikov DN, Perera A, Bartlett RJ
Chemical Physics Letters, 698, 171, 2018
3 Explicitly-correlated double ionization potentials and double electron attachment equation-of-motion coupled cluster methods
Bokhan D, Trubnikov DN, Perera A, Bartlett RJ
Chemical Physics Letters, 692, 191, 2018
4 Explicitly-correlated coupled cluster method for long-range dispersion coefficients
Bokhan D, Trubnikov DN, Perera A, Bartlett RJ
Chemical Physics Letters, 672, 133, 2017
5 Equation-of-motion coupled cluster method for ionized states with partial inclusion of connected triples: Assessment of the accuracy in regular and explicitly-correlated approaches
Bokhan D, Trubnikov DN, Musial M, Bartlett RJ
Chemical Physics Letters, 610, 173, 2014
6 On the definition of the microcanonical temperature of small weakly bound molecular clusters
Belega ED, Cheremukhin EA, Elyutin PV, Trubnikov DN
Chemical Physics Letters, 496(1-3), 167, 2010
7 DFT analysis of propane cyclization over binuclear Ga-clusters in mordenite
Larina AV, Zhidomirov GM, Trubnikov DN, Vercauteren DP
Journal of Molecular Catalysis A-Chemical, 305(1-2), 90, 2009
8 The Partition-Functions and Thermodynamic Properties of Small Clusters of Rare-Gas Atoms
Elyutin PV, Baranov VI, Belega ED, Trubnikov DN
Journal of Chemical Physics, 100(5), 3843, 1994