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10,331 to 10,340 of 10,511 Results

outliers_manual.tab May 31, 2017 - Supporting data for "A Standard Operating Procedure for Outlier Removal in Large-Sample Epidemiological Transcriptomics Datasets" Tabular Data - 40 B - 2 Variables, 4 Observations - UNF:6:ZMptJWT3FxBSa7GBn12qJg== See README.txt
outliers.rda May 31, 2017 - Supporting data for "A Standard Operating Procedure for Outlier Removal in Large-Sample Epidemiological Transcriptomics Datasets" R Data - 269 B - MD5: 0cdeb300f6b059adc518b88b77800f9b See README.txt
README.txt May 31, 2017 - Supporting data for "A Standard Operating Procedure for Outlier Removal in Large-Sample Epidemiological Transcriptomics Datasets" Plain Text - 3.6 KB - MD5: ab2a41d2a0eff3a476d9fb07311cd805 Documentation
sop_data.rda May 31, 2017 - Supporting data for "A Standard Operating Procedure for Outlier Removal in Large-Sample Epidemiological Transcriptomics Datasets" R Data - 911.6 MB - MD5: acefcf93dd48f460e23430e2189f6360 See README.txt
GGA-PBE and hybrid-PBE0 energies and dipole moments with MRChem, FHI-aims, NWChem and ELK Mar 9, 2017 Jensen, Stig Rune; Saha, Santanu; Flores-Livas, José Abdenago; Huhn, William; Blum, Volker; Goedecker, Stefan; Frediani, Luca, 2017, "GGA-PBE and hybrid-PBE0 energies and dipole moments with MRChem, FHI-aims, NWChem and ELK", https://doi.org/10.18710/0EM0EL, DataverseNO, V3 Highly accurate Density Functional Theory (GGA-PBE and hybrid-PBE0) total energies, atomization energies and dipole moments computed with four different electronic structure codes: MRChem using multiwavelet basis sets; FHI-aims using numeric atom-centered orbitals; NWChem using G...
computational_details.pdf Mar 9, 2017 - GGA-PBE and hybrid-PBE0 energies and dipole moments with MRChem, FHI-aims, NWChem and ELK Adobe PDF - 191.1 KB - MD5: 90941b3b97728432378b8d0c63eb68cf
PBE_atomic_energies.txt Mar 9, 2017 - GGA-PBE and hybrid-PBE0 energies and dipole moments with MRChem, FHI-aims, NWChem and ELK Plain Text - 17.5 KB - MD5: cf7c7c71b93930705ea364231056e1b5
PBE_atomization_energies.txt Mar 9, 2017 - GGA-PBE and hybrid-PBE0 energies and dipole moments with MRChem, FHI-aims, NWChem and ELK Plain Text - 136.1 KB - MD5: 3366615757465ca5df7f43e7f637cf5e
PBE_dipole_moments.txt Mar 9, 2017 - GGA-PBE and hybrid-PBE0 energies and dipole moments with MRChem, FHI-aims, NWChem and ELK Plain Text - 128.5 KB - MD5: c20ba5a870db66b393107a5b7c69d434
PBE_molecular_energies.txt Mar 9, 2017 - GGA-PBE and hybrid-PBE0 energies and dipole moments with MRChem, FHI-aims, NWChem and ELK Plain Text - 144.1 KB - MD5: 88a0c12e8d86f87a954e173318d38291

outliers_manual.tab

May 31, 2017 - Supporting data for "A Standard Operating Procedure for Outlier Removal in Large-Sample Epidemiological Transcriptomics Datasets"

Tabular Data - 40 B - 2 Variables, 4 Observations -

See README.txt

outliers.rda

May 31, 2017 - Supporting data for "A Standard Operating Procedure for Outlier Removal in Large-Sample Epidemiological Transcriptomics Datasets"

R Data - 269 B -

See README.txt

README.txt

May 31, 2017 - Supporting data for "A Standard Operating Procedure for Outlier Removal in Large-Sample Epidemiological Transcriptomics Datasets"

Plain Text - 3.6 KB -

Documentation

sop_data.rda

May 31, 2017 - Supporting data for "A Standard Operating Procedure for Outlier Removal in Large-Sample Epidemiological Transcriptomics Datasets"

R Data - 911.6 MB -

See README.txt

GGA-PBE and hybrid-PBE0 energies and dipole moments with MRChem, FHI-aims, NWChem and ELK

Mar 9, 2017

Jensen, Stig Rune; Saha, Santanu; Flores-Livas, José Abdenago; Huhn, William; Blum, Volker; Goedecker, Stefan; Frediani, Luca, 2017, "GGA-PBE and hybrid-PBE0 energies and dipole moments with MRChem, FHI-aims, NWChem and ELK", https://doi.org/10.18710/0EM0EL, DataverseNO, V3

Highly accurate Density Functional Theory (GGA-PBE and hybrid-PBE0) total energies, atomization energies and dipole moments computed with four different electronic structure codes: MRChem using multiwavelet basis sets; FHI-aims using numeric atom-centered orbitals; NWChem using G...

computational_details.pdf

Mar 9, 2017 - GGA-PBE and hybrid-PBE0 energies and dipole moments with MRChem, FHI-aims, NWChem and ELK

Adobe PDF - 191.1 KB -

PBE_atomic_energies.txt

Mar 9, 2017 - GGA-PBE and hybrid-PBE0 energies and dipole moments with MRChem, FHI-aims, NWChem and ELK

Plain Text - 17.5 KB -

PBE_atomization_energies.txt

Mar 9, 2017 - GGA-PBE and hybrid-PBE0 energies and dipole moments with MRChem, FHI-aims, NWChem and ELK

Plain Text - 136.1 KB -

PBE_dipole_moments.txt

Mar 9, 2017 - GGA-PBE and hybrid-PBE0 energies and dipole moments with MRChem, FHI-aims, NWChem and ELK

Plain Text - 128.5 KB -

PBE_molecular_energies.txt

Mar 9, 2017 - GGA-PBE and hybrid-PBE0 energies and dipole moments with MRChem, FHI-aims, NWChem and ELK

Plain Text - 144.1 KB -

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