Year |
Citation |
Score |
2020 |
Lang RA, Ryabinkin IG, Izmaylov AF. Unitary Transformation of the Electronic Hamiltonian with an Exact Quadratic Truncation of the Baker-Campbell-Hausdorff Expansion. Journal of Chemical Theory and Computation. PMID 33295175 DOI: 10.1021/acs.jctc.0c00170 |
0.691 |
|
2020 |
Ryabinkin IG, Lang RA, Genin SN, Izmaylov AF. Iterative Qubit Coupled Cluster approach with efficient screening of generators. Journal of Chemical Theory and Computation. PMID 31935085 DOI: 10.1021/Acs.Jctc.9B01084 |
0.682 |
|
2019 |
Izmaylov AF, Yen TC, Ryabinkin IG. Revising the measurement process in the variational quantum eigensolver: is it possible to reduce the number of separately measured operators? Chemical Science. 10: 3746-3755. PMID 31015918 DOI: 10.1039/C8Sc05592K |
0.651 |
|
2018 |
Ryabinkin IG, Genin SN, Izmaylov AF. Relation between fermionic and qubit mean fields in the electronic structure problem. The Journal of Chemical Physics. 149: 214105. PMID 30525719 DOI: 10.1063/1.5055357 |
0.693 |
|
2018 |
Ryabinkin IG, Genin SN, Izmaylov AF. Constrained Variational Quantum Eigensolver: Quantum Computer Search Engine in the Fock Space. Journal of Chemical Theory and Computation. PMID 30512959 DOI: 10.1021/Acs.Jctc.8B00943 |
0.714 |
|
2018 |
Ryabinkin IG, Yen TC, Genin SN, Izmaylov AF. Qubit coupled cluster method: A systematic approach to quantum chemistry on a quantum computer. Journal of Chemical Theory and Computation. PMID 30427679 DOI: 10.1021/Acs.Jctc.8B00932 |
0.676 |
|
2017 |
Ryabinkin IG, Ospadov E, Staroverov VN. Exact exchange-correlation potentials of singlet two-electron systems. The Journal of Chemical Physics. 147: 164117. PMID 29096458 DOI: 10.1063/1.5003825 |
0.677 |
|
2017 |
Ryabinkin IG, Joubert-Doriol L, Izmaylov AF. Geometric Phase Effects in Nonadiabatic Dynamics near Conical Intersections. Accounts of Chemical Research. PMID 28665584 DOI: 10.1021/Acs.Accounts.7B00220 |
0.719 |
|
2017 |
Ospadov E, Ryabinkin IG, Staroverov VN. Improved method for generating exchange-correlation potentials from electronic wave functions. The Journal of Chemical Physics. 146: 084103. PMID 28249436 DOI: 10.1063/1.4975990 |
0.648 |
|
2017 |
Ryabinkin IG, Izmaylov AF. Mixed Quantum-Classical Dynamics Using Collective Electronic Variables: A Better Alternative to Electronic Friction Theories. The Journal of Physical Chemistry Letters. 440-444. PMID 28036176 DOI: 10.1021/Acs.Jpclett.6B02712 |
0.693 |
|
2017 |
Joubert-Doriol L, Sivasubramanium J, Ryabinkin IG, Izmaylov AF. Topologically Correct Quantum Nonadiabatic Formalism for On-the-Fly Dynamics. The Journal of Physical Chemistry Letters. 452-456. PMID 28036173 DOI: 10.1021/Acs.Jpclett.6B02660 |
0.703 |
|
2016 |
Ryabinkin IG, Kohut SV, Cuevas-Saavedra R, Ayers PW, Staroverov VN. Response to "Comment on 'Kohn-Sham exchange-correlation potentials from second-order reduced density matrices'" [J. Chem. Phys. 145, 037101 (2016)]. The Journal of Chemical Physics. 145: 037102. PMID 27448911 DOI: 10.1063/1.4958623 |
0.613 |
|
2016 |
Gherib R, Ye L, Ryabinkin IG, Izmaylov AF. On the inclusion of the diagonal Born-Oppenheimer correction in surface hopping methods. The Journal of Chemical Physics. 144: 154103. PMID 27389205 DOI: 10.1063/1.4945817 |
0.681 |
|
2016 |
Klinkova A, Cherepanov PV, Ryabinkin IG, Ho M, Ashokkumar M, Izmaylov AF, Andreeva DV, Kumacheva E. Shape-Dependent Interactions of Palladium Nanocrystals with Hydrogen. Small (Weinheim An Der Bergstrasse, Germany). PMID 26997362 DOI: 10.1002/Smll.201600015 |
0.579 |
|
2016 |
Gherib R, Ye L, Ryabinkin IG, Izmaylov AF. On the inclusion of the diagonal Born-Oppenheimer correction in surface hopping methods Journal of Chemical Physics. 144. DOI: 10.1063/1.4945817 |
0.662 |
|
2015 |
Gherib R, Ryabinkin IG, Izmaylov AF. Why Do Mixed Quantum-Classical Methods Describe Short-Time Dynamics through Conical Intersections So Well? Analysis of Geometric Phase Effects. Journal of Chemical Theory and Computation. 11: 1375-82. PMID 26574349 DOI: 10.1021/Acs.Jctc.5B00072 |
0.686 |
|
2015 |
Ryabinkin IG, Nagesh J, Izmaylov AF. Fast Numerical Evaluation of Time-Derivative Nonadiabatic Couplings for Mixed Quantum-Classical Methods. The Journal of Physical Chemistry Letters. 6: 4200-3. PMID 26538034 DOI: 10.1021/Acs.Jpclett.5B02062 |
0.683 |
|
2015 |
Ryabinkin IG, Staroverov VN. Erratum: "Average local ionization energy generalized to correlated wavefunctions" [J. Chem. Phys. 141, 084107 (2014)]. The Journal of Chemical Physics. 143: 159901. PMID 26493927 DOI: 10.1063/1.4934358 |
0.613 |
|
2015 |
Ryabinkin IG, Kohut SV, Staroverov VN. Reduction of Electronic Wave Functions to Kohn-Sham Effective Potentials. Physical Review Letters. 115: 083001. PMID 26340185 DOI: 10.1103/Physrevlett.115.083001 |
0.697 |
|
2015 |
Gherib R, Ryabinkin IG, Izmaylov AF. Why do mixed quantum-classical methods describe short-time dynamics through conical intersections so well? Analysis of geometric phase effects Journal of Chemical Theory and Computation. 11: 1375-1382. DOI: 10.1021/acs.jctc.5b00072 |
0.619 |
|
2014 |
Joubert-Doriol L, Ryabinkin IG, Izmaylov AF. Non-stochastic matrix Schrödinger equation for open systems. The Journal of Chemical Physics. 141: 234112. PMID 25527924 DOI: 10.1063/1.4903829 |
0.666 |
|
2014 |
Ryabinkin IG, Staroverov VN. Average local ionization energy generalized to correlated wavefunctions. The Journal of Chemical Physics. 141: 084107. PMID 25173005 DOI: 10.1063/1.4893424 |
0.687 |
|
2014 |
Ryabinkin IG, Joubert-Doriol L, Izmaylov AF. When do we need to account for the geometric phase in excited state dynamics? The Journal of Chemical Physics. 140: 214116. PMID 24907999 DOI: 10.1063/1.4881147 |
0.667 |
|
2014 |
Kohut SV, Ryabinkin IG, Staroverov VN. Hierarchy of model Kohn-Sham potentials for orbital-dependent functionals: a practical alternative to the optimized effective potential method. The Journal of Chemical Physics. 140: 18A535. PMID 24832343 DOI: 10.1063/1.4871500 |
0.683 |
|
2014 |
Ryabinkin IG, Hsieh CY, Kapral R, Izmaylov AF. Analysis of geometric phase effects in the quantum-classical Liouville formalism. The Journal of Chemical Physics. 140: 084104. PMID 24588145 DOI: 10.1063/1.4866366 |
0.698 |
|
2013 |
Gaiduk AP, Ryabinkin IG, Staroverov VN. Removal of Basis-Set Artifacts in Kohn-Sham Potentials Recovered from Electron Densities. Journal of Chemical Theory and Computation. 9: 3959-64. PMID 26592391 DOI: 10.1021/Ct4004146 |
0.769 |
|
2013 |
Joubert-Doriol L, Ryabinkin IG, Izmaylov AF. Geometric phase effects in low-energy dynamics near conical intersections: a study of the multidimensional linear vibronic coupling model. The Journal of Chemical Physics. 139: 234103. PMID 24359348 DOI: 10.1063/1.4844095 |
0.673 |
|
2013 |
Ryabinkin IG, Izmaylov AF. Geometric phase effects in dynamics near conical intersections: symmetry breaking and spatial localization. Physical Review Letters. 111: 220406. PMID 24329431 DOI: 10.1103/Physrevlett.111.220406 |
0.64 |
|
2013 |
Kananenka AA, Kohut SV, Gaiduk AP, Ryabinkin IG, Staroverov VN. Efficient construction of exchange and correlation potentials by inverting the Kohn-Sham equations. The Journal of Chemical Physics. 139: 074112. PMID 23968077 DOI: 10.1063/1.4817942 |
0.776 |
|
2013 |
Ryabinkin IG, Kananenka AA, Staroverov VN. Accurate and efficient approximation to the optimized effective potential for exchange. Physical Review Letters. 111: 013001. PMID 23862997 DOI: 10.1103/Physrevlett.111.013001 |
0.67 |
|
2013 |
Ryabinkin IG, Kananenka AA, Staroverov VN. Publisher’s Note: Accurate and Efficient Approximation to the Optimized Effective Potential for Exchange [Phys. Rev. Lett.111, 013001 (2013)] Physical Review Letters. 111. DOI: 10.1103/Physrevlett.111.059901 |
0.588 |
|
2013 |
Ryabinkin IG, Staroverov VN. Exact relations between the electron density and external potential for systems of interacting and noninteracting electrons International Journal of Quantum Chemistry. 113: 1626-1632. DOI: 10.1002/Qua.24374 |
0.679 |
|
2012 |
Ryabinkin IG, Staroverov VN. Determination of Kohn-Sham effective potentials from electron densities using the differential virial theorem. The Journal of Chemical Physics. 137: 164113. PMID 23126701 DOI: 10.1063/1.4763481 |
0.691 |
|
2011 |
Ryabinkin IG, Staroverov VN. Interelectron magnetic coupling in electrides with one-dimensional cavity-channel geometry. Physical Chemistry Chemical Physics : Pccp. 13: 21615-20. PMID 22068221 DOI: 10.1039/C1Cp22389E |
0.572 |
|
2011 |
Ryabinkin IG, Staroverov VN. Accurate explicitly correlated wave functions for two electrons in a square. The Journal of Chemical Physics. 135: 014106. PMID 21744887 DOI: 10.1063/1.3603451 |
0.661 |
|
2010 |
Ryabinkin IG, Staroverov VN. Solution of the Schrödinger equation for two electrons in axially symmetric cavities Physical Review a - Atomic, Molecular, and Optical Physics. 82. DOI: 10.1103/Physreva.82.022505 |
0.63 |
|
2010 |
Ryabinkin IG, Staroverov VN. Two electrons in a cylindrical box: An exact configuration-interaction solution Physical Review a - Atomic, Molecular, and Optical Physics. 81. DOI: 10.1103/Physreva.81.032509 |
0.681 |
|
2008 |
Polestshuk PM, Dem’yanov PI, Ryabinkin IG. The electronic structure and energetics of V+-benzene half-sandwiches of different multiplicities: Comparative multireference and single-reference theoretical study Journal of Chemical Physics. 129: 54307-54307. PMID 18698900 DOI: 10.1063/1.2955741 |
0.399 |
|
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