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Uğur Bozkaya

6PUBLICATIONS

34CO-AUTHORS

Theoretical quantum chemistry

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Publications (6)

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|Sep 23, 2021

Efficient implementations of the symmetric and asymmetric triple excitation corrections for the orbital-optimized coupled-cluster doubles method with the density-fitting approximation.

Yavuz Alagöz, Aslı Ünal, Uğur Bozkaya

|Dec 31, 2020

Energy and analytic gradients for the orbital-optimized coupled-cluster doubles method with the density-fitting approximation: An efficient implementation.

Uğur Bozkaya, Aslı Ünal, Yavuz Alagöz

|May 17, 2020

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

Daniel G A Smith, Lori A Burns, Andrew C Simmonett

|Apr 04, 2020

Efficient and automated computation of accurate molecular geometries using focal-point approximations to large-basis coupled-cluster theory.

Constance E Warden, Daniel G A Smith, Lori A Burns

|Apr 02, 2018

Anionic water pentamer and hexamer clusters: An extensive study of structures and energetics.

Aslı Ünal, Uğur Bozkaya

|Aug 03, 2017

Analytic energy gradients for the coupled-cluster singles and doubles with perturbative triples method with the density-fitting approximation.

Uğur Bozkaya, C David Sherrill

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Frequent Collaborators

3 joint publications

C David Sherrill

2 joint publications

Daniel G A Smith

2 joint publications

Lori A Burns

2 joint publications

Yavuz Alagöz

2 joint publications

Aslı Ünal

1 joint publications

Andrew C Simmonett

1 joint publications

Robert M Parrish

1 joint publications

Raimondas Galvelis

1 joint publications

Peter Kraus

1 joint publications

Holger Kruse

Frequent Collaborators

3 joint publications

C David Sherrill

2 joint publications

Daniel G A Smith

2 joint publications

Lori A Burns

2 joint publications

Yavuz Alagöz

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