Multi-level parallelization of quantum-chemical calculations von Fedorov, Dmitri G., Pham, Buu Q.

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Porting Fragmentation Methods to Graphical Processing Units Using an OpenMP Application Programming Interface: Offloading the Fock Build for Low Angular Momentum Functions von Pham, Buu Q., Alkan, Melisa, Gordon, Mark S.

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Recent developments in the general atomic and molecular electronic structure system von Barca, Giuseppe M. J., Bertoni, Colleen, Carrington, Laura, Datta, Dipayan, De Silva, Nuwan, Deustua, J. Emiliano, Fedorov, Dmitri G., Gour, Jeffrey R., Gunina, Anastasia O., Guidez, Emilie, Harville, Taylor, Irle, Stephan, Ivanic, Joe, Kowalski, Karol, Leang, Sarom S., Li, Hui, Li, Wei, Lutz, Jesse J., Magoulas, Ilias, Mato, Joani, Mironov, Vladimir, Nakata, Hiroya, Pham, Buu Q., Piecuch, Piotr, Poole, David, Pruitt, Spencer R., Rendell, Alistair P., Roskop, Luke B., Ruedenberg, Klaus, Sattasathuchana, Tosaporn, Schmidt, Michael W., Shen, Jun, Slipchenko, Lyudmila, Sosonkina, Masha, Sundriyal, Vaibhav, Tiwari, Ananta, Galvez Vallejo, Jorge L., Westheimer, Bryce, Włoch, Marta, Xu, Peng, Zahariev, Federico, Gordon, Mark S.

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Hybrid Distributed/Shared Memory Model for the RI-MP2 Method in the Fragment Molecular Orbital Framework von Pham, Buu Q, Gordon, Mark S

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Enabling Fortran Standard Parallelism in GAMESS for Accelerated Quantum Chemistry Calculations von Alkan, Melisa, Pham, Buu Q., Hammond, Jeff R., Gordon, Mark S.

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Development of the FMO/RI-MP2 Fully Analytic Gradient Using a Hybrid-Distributed/Shared Memory Programming Model von Pham, Buu Q, Gordon, Mark S

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PDG: A Composite Method Based on the Resolution of the Identity von Pham, Buu Q, Datta, Dipayan, Gordon, Mark S

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High-performance strategies for the recent MRSF-TDDFT in GAMESS von Komarov, Konstantin, Mironov, Vladimir, Lee, Seunghoon, Pham, Buu Q., Gordon, Mark S., Choi, Cheol Ho

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Polydopamine coating of uncrosslinked chitosan as an acellular scaffold for full thickness skin grafts von Bock, Nathalie, Pham, Truc Le-Buu, Nguyen, Tran Bao, Nguyen, Trong Binh, Tran, Hien A., Tran, Phong A.

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The Effective Fragment Molecular Orbital Method: Achieving High Scalability and Accuracy for Large Systems von Sattasathuchana, Tosaporn, Xu, Peng, Bertoni, Colleen, Kim, Yu Lim, Leang, Sarom S., Pham, Buu Q., Gordon, Mark S.

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Compressing the Four-Index Two-Electron Repulsion Integral Matrix using the Resolution-of-the-Identity Approximation Combined with the Rank Factorization Approximation von Pham, Buu Q, Gordon, Mark S

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Porting fragmentation methods to GPUs using an OpenMP API: Offloading the resolution-of-the-identity second-order Møller–Plesset perturbation method von Pham, Buu Q., Carrington, Laura, Tiwari, Ananta, Leang, Sarom S., Alkan, Melisa, Bertoni, Colleen, Datta, Dipayan, Sattasathuchana, Tosaporn, Xu, Peng, Gordon, Mark S.

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LibERI—A portable and performant multi-GPU accelerated library for electron repulsion integrals via OpenMP offloading and standard language parallelism von Alkan, Melisa, Pham, Buu Q., Del Angel Cruz, Daniel, Hammond, Jeff R., Barnes, Taylor A., Gordon, Mark S.

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Can Orbitals Really Be Observed in Scanning Tunneling Microscopy Experiments? von Pham, Buu Q, Gordon, Mark S

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Quantum Chemical Modeling of Propellant Degradation von Galvez Vallejo, Jorge L., Tow, Garrett M., Maginn, Edward J., Pham, Buu Q., Datta, Dipayan, Gordon, Mark S.

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Quantum chemical investigation of epoxide and ether groups in graphene oxide and their vibrational spectra von PAGE, Alister J, CHOU, Chien-Pin, PHAM, Buu Q, WITEK, Henryk A, IRLE, Stephan, MOROKUMA, Keiji

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A Facile Synthesis Process and Evaluations of alpha-Calcium Sulfate Hemihydrate for Bone Substitute von Le, Nhi Thao Ngoc, Le, Ngoc Thuy Trang, Nguyen, Quang Lam, Pham, Truc Le-Buu, Nguyen-Le, Minh-Tri, Nguyen, Dai Hai

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Development and Characterization of Soy Lecithin Liposome as Potential Drug Carrier Systems for Codelivery of Letrozole and Paclitaxel von Pham, Truc Le-Buu, Nguyen, Ngoc Hoi, Nguyen, Dai Hai, Le, Ngoc Thuy Trang, Vu, Minh Thanh

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The 2D-to-3D geometry hopping in small boron clusters: The charge effect von Pham, Hung Tan, Duong, Long Van, Pham, Buu Quoc, Nguyen, Minh Tho

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Stem cell sheet fabrication from human umbilical cord mesenchymal stem cell and Col-T scaffold von Le-Buu Pham, Truc, Nguyen, Tram Mai, Phu-Hai Nguyen, Dang, Tran, Huynh Nhu, Thi-Thanh Nguyen, Tam, Binh, Nguyen Trong, Nguyen, Quan Dang, Bui, Hong-Thuy

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