ICET–a Python library for constructing and sampling alloy cluster expansions M Ångqvist, WA Muñoz, JM Rahm, E Fransson, C Durniak, P Rozyczko, ... Advanced Theory and Simulations 2 (7), 1900015, 2019 | 137 | 2019 |
ACES II is a program product of the Quantum Theory Project, University of Florida. Integral packages included are VMOL (J. Almlöf and PR Taylor); VPROPS (P. Taylor) JF Stanton, J Gauss, JD Watts, M Nooijen, N Oliphant, SA Perera, ... ABACUS (T. Helgaker, HJ Aa. Jensen, P. Jørgensen, J. Olsen and PR Taylor), 2005 | 121* | 2005 |
ACES II, a program product of the Quantum Theory Project JF Stanton, J Gauss, JD Watts, M Nooijen, N Oliphant, SA Perera, ... University of Florida, 1992 | 96 | 1992 |
Integral packages included are VMOL (Almlöf, J.; Taylor, PR) J Gauss, JD Watts, M Nooijen, N Oliphant, SA Perera, PG Szalay, ... Vprops (Taylor, PR), 0 | 65 | |
Correlated calculations of molecular dynamic polarizabilities PB Rozyczko, SA Perera, M Nooijen, RJ Bartlett The Journal of chemical physics 107 (17), 6736-6747, 1997 | 64 | 1997 |
Frequency dependent equation-of-motion coupled cluster hyperpolarizabilities: Resolution of the discrepancy between theory and experiment for HF? P Rozyczko, RJ Bartlett The Journal of chemical physics 107 (24), 10823-10826, 1997 | 41 | 1997 |
ACES II, a program product of the Quantum Theory Project; University of Florida, Gainesville, FL JF Stanton, J Gauss, JD Watts, M Nooijen, N Oliphant, SA Perera, ... Google Scholar There is no corresponding record for this reference, 0 | 29 | |
Amino-acid adsorption in MFI-type zeolites enabled by the pH-dependent ability to displace water K Stückenschneider, J Merz, F Hanke, P Rozyczko, V Milman, ... The Journal of Physical Chemistry C 117 (37), 18927-18935, 2013 | 25 | 2013 |
Does N2− exist? A coupled-cluster study GL Gutsev, PB Rozyczko, RJ Bartlett, CA Weatherford The Journal of chemical physics 110 (11), 5137-5139, 1999 | 18 | 1999 |
Integral packages included are VMOL (J. Almlöf and PR Taylor); VPROPS (P. Taylor) ABACUS;(T. Helgaker, HJ Aa. Jensen, P. Jörgensen, J. Olsen, and PR Taylor): ACES II JF Stanton, J Gauss, JD Watts, M Nooijen, N Oliphant, SA Perera, ... Quantum Theory Project, Gainesville, Florida, 2007 | 17* | 2007 |
The hyperpolarizability of trans-butadiene rerevisited PB Rozyczko, RJ Bartlett The Journal of chemical physics 108 (19), 7988-7993, 1998 | 17 | 1998 |
ACES II is a product of the Quantum Theory Project, University of Florida JF Stanton, J Gauss, SA Perera, A Yau, JD Watts, M Nooijen, N Oliphant, ... Integral Packages Included are VMOL (J. Almlöf and PR Taylor), VPROPS (PR …, 2009 | 14 | 2009 |
ACESII is a product of the quantum theory project JF Stanton, J Gauss, SA Perera, A Yau, JD Watts, M Nooijen, N Oliphant, ... University of Florida, Integral packages included are VMOL (J. Almölf and PR …, 2005 | 11 | 2005 |
ACES II; University of Florida: Gainesville, Fl JF Stanton, J Gauss, JD Watts, M Nooijen, N Oliphant, SA Perera, ... Google Scholar There is no corresponding record for this reference, 0 | 11 | |
Integral packages included are VMOL (J. Alml öf, PR Taylor), VPROPS (PR Taylor) JF Stanton, J Gauss, JD Watts, M Nooijen, N Oliphant, SA Perera, ... ABACUS (T. Helgaker, HJ Aa. Jensen, P. Jørgensen, J. Olsen, and PR Taylor), 2007 | 10 | 2007 |
Integral packages included are VMOL (J. Almlöf and PR Taylor) JF Stanton, J Gauss, JD Watts, M Nooijen, N Oliphant, SA Perera, ... VPROPS (P. Taylor) ABACUS, 0 | 10 | |
Response to “Comment on ‘Frequency-dependent equation-of-motion coupled cluster hyperpolarizabilities: Resolution of the discrepancy between theory and experiment for HF?’”[J … PB Rozyczko, RJ Bartlett The Journal of Chemical Physics 109 (20), 9201-9203, 1998 | 7 | 1998 |
Google Scholar There is no corresponding record for this reference J Gauss, JD Watts, M Nooijen, N Oliphant, SA Perera, PG Szalay, ... Integral packages included are VMOL (Almlöf, J, 1986 | 7 | 1986 |
SasView version 5.0. 4, 2021 M Doucet, JH Cho, G Alina, Z Attala, J Bakker, W Bouwman, P Butler, ... Google Scholar There is no corresponding record for this reference, 0 | 7 | |
Guidelines for collaborative development of sustainable data treatment software J Wuttke, S Cottrell, MA Gonzalez, A Kaestner, A Markvardsen, TH Rod, ... Journal of Neutron Research 24 (1), 33-72, 2022 | 6 | 2022 |