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Sirianni, Dominic A.
17  Ergebnisse:
Personensuche X
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1

Variations on the Bergman Cyclization Theme: Electrocycliza..:

Sirianni, Dominic A. ; Song, Xinli ; Wairegi, Salmika...
Journal of the American Chemical Society.  145 (2023)  39 - p. 21408-21418 , 2023
Link: https://doi.org/10.1021/..
 
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2

The influence of a solvent environment on direct non-covale..:

Sirianni, Dominic A. ; Zhu, Xiao ; Sitkoff, Doree F...
The Journal of Chemical Physics.  156 (2022)  19 - p. , 2022
Link: https://doi.org/10.1063/..
 
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3

Optimized damping parameters for empirical dispersion corre..:

Schriber, Jeffrey B. ; Sirianni, Dominic A. ; Smith, Daniel G. A....
The Journal of Chemical Physics.  154 (2021)  23 - p. , 2021
Link: https://doi.org/10.1063/..
 
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4

PSI4 1.4: Open-source software for high-throughput quantum ..:

Smith, Daniel G. A. ; Burns, Lori A. ; Simmonett, Andrew C....
The Journal of Chemical Physics.  152 (2020)  18 - p. , 2020
Link: https://doi.org/10.1063/..
 
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5

Psi4NumPy: An Interactive Quantum Chemistry Programming Env..:

Smith, Daniel G. A. ; Burns, Lori A. ; Sirianni, Dominic A....
Journal of Chemical Theory and Computation.  14 (2018)  7 - p. 3504-3511 , 2018
Link: https://doi.org/10.1021/..
 
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6

Tipping the Balance between S-π and O-π Interactions:

Hwang, Jungwun ; Li, Ping ; Smith, Mark D....
Journal of the American Chemical Society.  140 (2018)  41 - p. 13301-13307 , 2018
Link: https://doi.org/10.1021/..
 
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7

Assessment of Density Functional Methods for Geometry Optim..:

Sirianni, Dominic A. ; Alenaizan, Asem ; Cheney, Daniel L..
Journal of Chemical Theory and Computation.  14 (2018)  6 - p. 3004-3013 , 2018
Link: https://doi.org/10.1021/..
 
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8

Comparison of Explicitly Correlated Methods for Computing H..:

Sirianni, Dominic A. ; Burns, Lori A. ; Sherrill, C. David
Journal of Chemical Theory and Computation.  13 (2016)  1 - p. 86-99 , 2016
Link: https://doi.org/10.1021/..
 
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9

PSI4 1.4: Open-source software for high-throughput quantum ..:

Schaefer, Henry F ; Hohenstein, Edward G ; Pritchard, Benjamin P...
a7527ee2-7cdd-4b95-a2c1-eb669ca8aca6.  , 2020
Link: https://doi.org/10.1063/..
 
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10

PSI4 1.4 : Open-source software for high-throughput quantum..:

Smith, Daniel G. A ; Burns, Lori A ; Simmonett, Andrew C...
10.1063/5.0006002.  , 2020
Link: http://hdl.handle.net/10..
 
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11

Psi4 1.4: Open-source software for high-throughput quantum ..:

Smith, Daniel G. A ; Burns, Lori A ; Simmonett, Andrew C...
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC7228781/.  , 2020
Link: http://www.ncbi.nlm.nih...
 
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12

PSI4 1.4: Open-source software for high-throughput quantum ..:

Smith, Daniel G. A ; Burns, Lori A ; Simmonett, Andrew C...
https://aperta.ulakbim.gov.tr/record/5361.  , 2020
Link: https://aperta.ulakbim.g..
 
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13

psi4/psi4numpy: v1.0-beta:

Daniel Smith ; Dominic A. Sirianni ; Ashutosh Kumar...
https://github.com/psi4/psi4numpy/tree/v1.0-beta.  , 2018
Link: https://zenodo.org/recor..
 
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14

psi4/psi4numpy v1.0:

Daniel Smith ; Dominic A. Sirianni ; Ashutosh Kumar...
https://github.com/psi4/psi4numpy/tree/v1.0.  , 2018
Link: https://zenodo.org/recor..
 
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15

psi4/psi4numpy: v0.2-beta:

Daniel Smith ; Dominic A. Sirianni ; Lori A. Burns..
https://github.com/psi4/psi4numpy/tree/v0.2-beta.  , 2017
Link: https://zenodo.org/recor..
 
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