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Quantum simulation of electronic structure with a transcorrelated Hamiltonian: improved accuracy with a smaller footprint on the quantum computer
by
Motta, Mario
,
Gujarati, Tanvi P
,
Rice, Julia E
,
Kumar, Ashutosh
,
Masteran, Conner
,
Latone, Joseph A
,
Lee, Eunseok
,
Valeev, Edward F
,
Takeshita, Tyler Y
Published in
Physical chemistry chemical physics : PCCP
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Massively Parallel Quantum Chemistry: A high-performance research platform for electronic structure
by
Peng, Chong
,
Lewis, Cannada A.
,
Wang, Xiao
,
Clement, Marjory C.
,
Pierce, Karl
,
Rishi, Varun
,
Pavošević, Fabijan
,
Slattery, Samuel
,
Zhang, Jinmei
,
Teke, Nakul
,
Kumar, Ashutosh
,
Masteran, Conner
,
Asadchev, Andrey
,
Calvin, Justus A.
,
Valeev, Edward F.
Published in
The Journal of chemical physics
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Comment on “Canonical transcorrelated theory with projected Slater-type geminals” [J. Chem. Phys. 136, 084107 (2012)]
by
Masteran, Conner
,
Kumar, Ashutosh
,
Teke, Nakul
,
Gaudel, Bimal
,
Yanai, Takeshi
,
Valeev, Edward F.
Published in
The Journal of chemical physics
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Quantum Simulation of Molecular Electronic States with a Transcorrelated Hamiltonian: Higher Accuracy with Fewer Qubits
by
Kumar, Ashutosh
,
Asthana, Ayush
,
Masteran, Conner
,
Valeev, Edward F.
,
Zhang, Yu
,
Cincio, Lukasz
,
Tretiak, Sergei
,
Dub, Pavel A.
Published in
Journal of chemical theory and computation
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Comment on "Canonical transcorrelated theory with projected Slater-type geminals" [J. Chem. Phys. 136, 084107 (2012)]
by
Conner Masteran
,
Kumar, Ashutosh
,
Teke, Nakul
,
Gaudel, Bimal
,
Yanai, Takeshi
,
Valeev, Edward F
Published in
arXiv.org
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Synthesis of a Water-Soluble, Soft N-Donor BTzBP Ligand Containing Only CHON
by
Labb, Samantha A.
,
Masteran, Conner J.
,
Albright, Savannah G.
,
Ali, Bakr
,
Chapman, Hayley A.
,
Cheng, Yijie
,
Cusic, Rachel M.
,
Hartlove, Nathan B.
,
Marr, Alissa N.
,
Timmons, Miranda
,
Friese, Seth J.
Published in
Synlett
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Quantum simulation of electronic structure with a transcorrelated Hamiltonian: improved accuracy with a smaller footprint on the quantum computer
by
Motta, Mario
,
Gujarati, Tanvi P
,
Rice, Julia E
,
Kumar, Ashutosh
,
Conner Masteran
,
Latone, Joseph A
,
Lee, Eunseok
,
Valeev, Edward F
,
Takeshita, Tyler Y
Published in
arXiv.org
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Accurate quantum simulation of molecular ground and excited states with a transcorrelated Hamiltonian
by
Kumar, Ashutosh
,
Asthana, Ayush
,
Conner Masteran
,
Valeev, Edward F
,
Zhang, Yu
,
Cincio, Lukasz
,
Tretiak, Sergei
,
Dub, Pavel A
Published in
arXiv.org
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