Year |
Citation |
Score |
2023 |
Zahariev F, Xu P, Westheimer BM, Webb S, Galvez Vallejo J, Tiwari A, Sundriyal V, Sosonkina M, Shen J, Schoendorff G, Schlinsog M, Sattasathuchana T, Ruedenberg K, Roskop LB, Rendell AP, ... ... Guidez E, et al. The General Atomic and Molecular Electronic Structure System (GAMESS): Novel Methods on Novel Architectures. Journal of Chemical Theory and Computation. 19: 7031-7055. PMID 37793073 DOI: 10.1021/acs.jctc.3c00379 |
0.402 |
|
2021 |
Xu P, Sattasathuchana T, Guidez E, Webb SP, Montgomery K, Yasini H, Pedreira IFM, Gordon MS. Computation of host-guest binding free energies with a new quantum mechanics based mining minima algorithm. The Journal of Chemical Physics. 154: 104122. PMID 33722015 DOI: 10.1063/5.0040759 |
0.433 |
|
2020 |
Guidez EB, Gordon MS, Ruedenberg K. Why is SiH not linear? An intrinsic quasi-atomic bonding analysis. Journal of the American Chemical Society. PMID 32662651 DOI: 10.1021/Jacs.0C03082 |
0.477 |
|
2020 |
Barca GMJ, Bertoni C, Carrington L, Datta D, De Silva N, Deustua JE, Fedorov DG, Gour JR, Gunina AO, Guidez E, Harville T, Irle S, Ivanic J, Kowalski K, Leang SS, et al. Recent developments in the general atomic and molecular electronic structure system. The Journal of Chemical Physics. 152: 154102. PMID 32321259 DOI: 10.1063/5.0005188 |
0.487 |
|
2020 |
Mato J, Guidez EB. Accuracy of the PM6 and PM7 Methods on Bare and Thiolate-Protected Gold Nanoclusters. The Journal of Physical Chemistry. A. 124: 2601-2615. PMID 32154717 DOI: 10.1021/Acs.Jpca.9B11474 |
0.378 |
|
2018 |
Schoeberle L, Guidez EB, Gordon MS. Benchmarking of the R Anisotropic Dispersion Energy Term on the S22 Dimer Test Set. The Journal of Physical Chemistry. A. PMID 29965762 DOI: 10.1021/Acs.Jpca.8B04451 |
0.44 |
|
2018 |
Kim S, Kaliszewski CM, Guidez EB, Gordon MS. Benchmarking the Effective Fragment Potential Dispersion Correction on the S22 Test Set. The Journal of Physical Chemistry. A. PMID 29601202 DOI: 10.1021/Acs.Jpca.7B11628 |
0.503 |
|
2018 |
Xu P, Guidez EB, Bertoni C, Gordon MS. Perspective:Ab initioforce field methods derived from quantum mechanics The Journal of Chemical Physics. 148: 090901. DOI: 10.1063/1.5009551 |
0.479 |
|
2018 |
Senanayake RD, Guidez EB, Neukirch AJ, Prezhdo OV, Aikens CM. Theoretical Investigation of Relaxation Dynamics in Au38(SH)24 Thiolate-Protected Gold Nanoclusters The Journal of Physical Chemistry C. 122: 16380-16388. DOI: 10.1021/Acs.Jpcc.8B03595 |
0.647 |
|
2017 |
Guidez EB, Gordon MS. Dispersion Interactions in Water Clusters. The Journal of Physical Chemistry. A. PMID 28379001 DOI: 10.1021/Acs.Jpca.6B11403 |
0.461 |
|
2017 |
Weerawardene KLDM, Guidez EB, Aikens CM. Photoluminescence Origin of Au38(SR)24 and Au22(SR)18 Nanoparticles: A Theoretical Perspective The Journal of Physical Chemistry C. 121: 15416-15423. DOI: 10.1021/Acs.Jpcc.7B01958 |
0.637 |
|
2016 |
Gordon MS, Guidez E, Xu P. Derivation and Implementation of the Gradient of the R-7 Dispersion Interaction in the Effective Fragment Potential Method. The Journal of Physical Chemistry. A. PMID 26745447 DOI: 10.1021/Acs.Jpca.5B11042 |
0.463 |
|
2015 |
Guidez EB, Aikens CM. Time-dependent density functional theory study of the luminescence properties of gold phosphine thiolate complexes. The Journal of Physical Chemistry. A. 119: 3337-47. PMID 25793466 DOI: 10.1021/Jp5104033 |
0.599 |
|
2015 |
Guidez EB, Gordon MS. Dispersion correction derived from first principles for density functional theory and Hartree-Fock theory. The Journal of Physical Chemistry. A. 119: 2161-8. PMID 25651435 DOI: 10.1021/Acs.Jpca.5B00379 |
0.531 |
|
2015 |
Luo H, Tuinenga C, Guidez EB, Lewis C, Shipman J, Roy S, Aikens CM, Chikan V. Synthesis and characterization of gallium-doped CdSe quantum dots Journal of Physical Chemistry C. 119: 10749-10757. DOI: 10.1021/Acs.Jpcc.5B01963 |
0.533 |
|
2014 |
Guidez EB, Aikens CM. Quantum mechanical origin of the plasmon: from molecular systems to nanoparticles. Nanoscale. 6: 11512-27. PMID 25163494 DOI: 10.1039/C4Nr02225D |
0.626 |
|
2014 |
Ding F, Guidez EB, Aikens CM, Li X. Quantum coherent plasmon in silver nanowires: a real-time TDDFT study. The Journal of Chemical Physics. 140: 244705. PMID 24985666 DOI: 10.1063/1.4884388 |
0.625 |
|
2014 |
Guidez EB, Aikens CM. Plasmon resonance analysis with configuration interaction. Physical Chemistry Chemical Physics : Pccp. 16: 15501-9. PMID 24953630 DOI: 10.1039/C4Cp01365D |
0.603 |
|
2013 |
Guidez EB, Aikens CM. Origin and TDDFT benchmarking of the plasmon resonance in acenes Journal of Physical Chemistry C. 117: 21466-21475. DOI: 10.1021/Jp4059033 |
0.618 |
|
2013 |
Guidez EB, Aikens CM. Diameter dependence of the excitation spectra of silver and gold nanorods Journal of Physical Chemistry C. 117: 12325-12336. DOI: 10.1021/Jp4023103 |
0.618 |
|
2012 |
Guidez EB, Aikens CM. Theoretical analysis of the optical excitation spectra of silver and gold nanowires. Nanoscale. 4: 4190-8. PMID 22495627 DOI: 10.1039/C2Nr30253E |
0.598 |
|
2012 |
Guidez EB, Aikens CM. Development of a charge-perturbed particle-in-a-sphere model for nanoparticle electronic structure. Physical Chemistry Chemical Physics : Pccp. 14: 4287-95. PMID 22333960 DOI: 10.1039/C2Cp23889F |
0.635 |
|
2012 |
Guidez EB, Mäkinen V, Häkkinen H, Aikens CM. Effects of silver doping on the geometric and electronic structure and optical absorption spectra of the Au 25- nAg n(SH) 18 - (n = 1, 2, 4, 6, 8, 10, 12) bimetallic nanoclusters Journal of Physical Chemistry C. 116: 20617-20624. DOI: 10.1021/Jp306885U |
0.622 |
|
2011 |
Guidez EB, Hadley A, Aikens CM. Initial growth mechanisms of Gold-phosphine clusters Journal of Physical Chemistry C. 115: 6305-6316. DOI: 10.1021/Jp112388Q |
0.553 |
|
Show low-probability matches. |