المؤلفون: Del Angel Cruz, Daniel, Ferreras, Katherine N., Harville, Taylor, Schoendorff, George, Gordon, Mark S.

المساهمون: Iowa State University, Air Force Office of Scientific Research, Chemical Sciences, Geosciences, and Biosciences Division

المصدر: Physical Chemistry Chemical Physics ; ISSN 1463-9076 1463-9084

الاتاحة: http://dx.doi.org/10.1039/d4cp01800a
http://pubs.rsc.org/en/content/articlepdf/2024/CP/D4CP01800A

المؤلفون: Nakamura, Taiji, Dangi, Beni B., Wu, Lu, Zhang, Yuchen, Schoendorff, George, Gordon, Mark S., Yang, Dong-Sheng

المصدر: Journal of Chemical Physics; 12/28/2023, Vol. 159 Issue 24, p1-12, 12p

مصطلحات موضوعية: SPIN-orbit interactions, ELECTRONS, ELECTRON configuration, ATOMS, IONIZATION energy, ELECTRON spin states, RARE earth metals, PRASEODYMIUM

المؤلفون: Nakamura, Taiji, Schoendorff, George, Yang, Dong-Sheng, Gordon, Mark S.

المصدر: Journal of Chemical Theory and Computation; January 2025, Vol. 21 Issue: 1 p267-282, 16p

المؤلفون: Cruz, Daniel Del Angel, Ferreras, Katherine N., Harville, Taylor, Schoendorff, George, Gordon, Mark S.

المصدر: Physical Chemistry Chemical Physics (PCCP); 8/28/2024, Vol. 26 Issue 32, p21395-21406, 12p

المؤلفون: Zhang, Yuchen, Nakamura, Taiji, Wu, Lu, Cao, Wenjin, Schoendorff, George, Gordon, Mark S., Yang, Dong-Sheng

المصدر: Journal of Chemical Physics; 9/21/2022, Vol. 157 Issue 11, p1-9, 9p

مصطلحات موضوعية: PERTURBATION theory, IONIZATION energy, SPIN-orbit interactions, ELECTRON impact ionization, SPECTROMETRY, ENERGY consumption, MILITARY communications, MOLECULAR beams

المؤلفون: Nakamura, Taiji, Schoendorff, George, Yang, Dong-Sheng, Gordon, Mark S.

المساهمون: Basic Energy Sciences, U.S. Department of Energy

المصدر: Journal of Chemical Theory and Computation ; volume 21, issue 1, page 267-282 ; ISSN 1549-9618 1549-9626

الاتاحة: https://doi.org/10.1021/acs.jctc.4c01196
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.4c01196

المؤلفون: Wu, Lu¹ (AUTHOR), Schoendorff, George^2,3 (AUTHOR), Zhang, Yuchen¹ (AUTHOR), Roudjane, Mourad¹ (AUTHOR), Gordon, Mark S.² (AUTHOR) mark@si.msg.chem.iastate.edu, Yang, Dong-Sheng¹ (AUTHOR) dyang0@uky.edu

المصدر: Journal of Chemical Physics. 2/28/2022, Vol. 156 Issue 8, p1-7. 7p.

مصطلحات موضوعية: *EXCITED states, *LUTETIUM, *CATIONS, *OXIDES, *VIBRATIONAL spectra, *MICROWAVE spectroscopy

المؤلفون: Schoendorff, George¹ (AUTHOR), Boatz, Jerry A.¹ (AUTHOR) jerry.boatz@us.af.mil

المصدر: Journal of Chemical Physics. 2/14/2022, Vol. 156 Issue 6, p1-13. 13p.

مصطلحات موضوعية: *APRIORI algorithm, *IONIZATION energy, *COMPUTER workstation clusters

المؤلفون: Zahariev, Federico, Xu, Peng, Westheimer, Bryce M., Webb, Simon, Galvez Vallejo, Jorge, Tiwari, Ananta, Sundriyal, Vaibhav, Sosonkina, Masha, Shen, Jun, Schoendorff, George, Schlinsog, Megan, Sattasathuchana, Tosaporn, Ruedenberg, Klaus, Roskop, Luke B., Rendell, Alistair P., Poole, David, Piecuch, Piotr, Pham, Buu Q., Mironov, Vladimir, Mato, Joani, Leonard, Sam, Leang, Sarom S., Ivanic, Joe, Hayes, Jackson, Harville, Taylor, Gururangan, Karthik, Guidez, Emilie, Gerasimov, Igor S., Friedl, Christian, Ferreras, Katherine N., Elliott, George, Datta, Dipayan, Cruz, Daniel Del Angel, Carrington, Laura, Bertoni, Colleen, Barca, Giuseppe M. J., Alkan, Melisa, Gordon, Mark S.

المصدر: Journal of Chemical Theory and Computation ; volume 19, issue 20, page 7031-7055 ; ISSN 1549-9618 1549-9626

الاتاحة: http://dx.doi.org/10.1021/acs.jctc.3c00379
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.3c00379

المؤلفون: Nakamura, Taiji, Dangi, Beni B., Wu, Lu, Zhang, Yuchen, Schoendorff, George, Gordon, Mark S., Yang, Dong-Sheng

المساهمون: Basic Energy Sciences, Ames Laboratory

المصدر: The Journal of Chemical Physics ; volume 159, issue 24 ; ISSN 0021-9606 1089-7690

الاتاحة: http://dx.doi.org/10.1063/5.0185579
https://pubs.aip.org/aip/jcp/article-pdf/doi/10.1063/5.0185579/18270803/244303_1_5.0185579.pdf

المؤلفون: Zhang, Yuchen, Nakamura, Taiji, Wu, Lu, Cao, Wenjin, Schoendorff, George, Gordon, Mark, Yang, Dong-Sheng

المساهمون: Chemistry, Ames Laboratory

المصدر: https://doi.org/10.1063/5.0113741.

مصطلحات موضوعية: DegreeDisciplines::Physical Sciences and Mathematics::Physics::Biological and Chemical Physics

وصف الملف: application/pdf

Relation: IS-J 10908; 1891620; https://dr.lib.iastate.edu/handle/20.500.12876/7wbO16Wv

الاتاحة: https://dr.lib.iastate.edu/handle/20.500.12876/7wbO16Wv
https://hdl.handle.net/20.500.12876/7wbO16Wv

المؤلفون: Schoendorff, George, Boatz, Jerry A.

المساهمون: Air Force Science and Technology Fellowship Program

المصدر: The Journal of Physical Chemistry A ; volume 126, issue 29, page 4848-4861 ; ISSN 1089-5639 1520-5215

الاتاحة: http://dx.doi.org/10.1021/acs.jpca.2c03342
https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.2c03342

المؤلفون: Schoendorff, George

المصدر: ACS Symposium Series ; Rare Earth Elements and Actinides: Progress in Computational Science Applications ; page 329-346 ; ISSN 0097-6156 1947-5918 ; ISBN 9780841298255 9780841298248

الاتاحة: http://dx.doi.org/10.1021/bk-2021-1388.ch015
https://pubs.acs.org/doi/pdf/10.1021/bk-2021-1388.ch015

المؤلفون: South, Christopher, Schoendorff, George, Wilson, Angela K.

المساهمون: National Science Foundation

المصدر: International Journal of Quantum Chemistry ; volume 116, issue 10, page 791-794 ; ISSN 0020-7608 1097-461X

الاتاحة: http://dx.doi.org/10.1002/qua.25128
https://api.wiley.com/onlinelibrary/tdm/v1/articles/10.1002%2Fqua.25128
https://onlinelibrary.wiley.com/doi/pdf/10.1002/qua.25128
https://onlinelibrary.wiley.com/doi/full-xml/10.1002/qua.25128
https://onlinelibrary.wiley.com/doi/am-pdf/10.1002/qua.25128

المؤلفون: Weber, Rebecca, Hovda, Benjamin, Schoendorff, George, Wilson, Angela K.

المساهمون: National Science Foundation, National Science Foundation GFRP, United States Department of Energy for the Center for Advanced Scientific Computing and Modeling

المصدر: Chemical Physics Letters ; volume 637, page 120-126 ; ISSN 0009-2614

الاتاحة: http://dx.doi.org/10.1016/j.cplett.2015.08.007
https://api.elsevier.com/content/article/PII:S0009261415005941?httpAccept=text/xml
https://api.elsevier.com/content/article/PII:S0009261415005941?httpAccept=text/plain

المؤلفون: Schoendorff, George, Ruedenberg, Klaus, Gordon, Mark S.

المساهمون: Department of Energy, US National Science Foundation

المصدر: The Journal of Physical Chemistry A ; volume 125, issue 22, page 4836-4846 ; ISSN 1089-5639 1520-5215

الاتاحة: http://dx.doi.org/10.1021/acs.jpca.1c02860
https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.1c02860

المؤلفون: Schoendorff, George, South, Christopher, Wilson, Angela K.

المصدر: The Journal of Physical Chemistry A ; volume 117, issue 42, page 10881-10888 ; ISSN 1089-5639 1520-5215

الاتاحة: http://dx.doi.org/10.1021/jp404654d
https://pubs.acs.org/doi/pdf/10.1021/jp404654d

المؤلفون: Schoendorff, George, West, Aaron, Schmidt, Michael, Ruedenberg, Klaus, Gordon, Mark

المساهمون: Ames Laboratory, Ames National Laboratory, Chemistry

المصدر: archive/lib.dr.iastate.edu/ameslab_manuscripts/380/0-IS_J_9977_SI.pdf|||Fri Jan 14 23:52:50 UTC 2022 ; archive/lib.dr.iastate.edu/ameslab_manuscripts/380/IS_J_9977.pdf|||Fri Jan 14 23:52:51 UTC 2022 ; 10.1021/acs.jpca.9b04023

مصطلحات موضوعية: Physical Chemistry

وصف الملف: application/pdf

Relation: IS-J 9977; archive/lib.dr.iastate.edu/ameslab_manuscripts/380/; 1383; ameslab_manuscripts/380; https://dr.lib.iastate.edu/handle/20.500.12876/7323

الاتاحة: https://dr.lib.iastate.edu/handle/20.500.12876/7323
https://hdl.handle.net/20.500.12876/7323

المؤلفون: Schoendorff, George, Schmidt, Michael W., Ruedenberg, Klaus, Gordon, Mark S.

المصدر: Ames Laboratory Accepted Manuscripts

مصطلحات موضوعية: Atomic, Molecular and Optical Physics, Physical Chemistry

وصف الملف: application/pdf

Relation: https://lib.dr.iastate.edu/ameslab_manuscripts/383; https://lib.dr.iastate.edu/cgi/viewcontent.cgi?article=1380&context=ameslab_manuscripts

الاتاحة: https://lib.dr.iastate.edu/ameslab_manuscripts/383
https://lib.dr.iastate.edu/cgi/viewcontent.cgi?article=1380&context=ameslab_manuscripts

المؤلفون: Schoendorff, George¹, Wilson, Angela K.¹ akwilson@unt.edu

المصدر: Journal of Chemical Physics. 6/14/2014, Vol. 140 Issue 22, p224314-1-224314-8. 8p. 6 Charts, 4 Graphs.

مصطلحات موضوعية: *NONFERROUS metals, *DISSOCIATION (Chemistry), *RARE earth metals, *ACIDITY function, *PROPERTIES of matter, *PHYSICAL & theoretical chemistry