Solid-state synthesis science analyzer (S4)
Contents
Calculations of thermodynamic quantities
Reaction cascade model
API References
Solid-state synthesis science analyzer (S4)
»
Index
Index
A
|
B
|
C
|
D
|
E
|
F
|
G
|
H
|
I
|
K
|
L
|
M
|
N
|
O
|
P
|
Q
|
R
|
S
|
T
|
V
A
A (s4.thermo.exp.EnthalpyEq attribute)
(s4.thermo.exp.GibbsFormationEq attribute)
amounts (s4.tmr.MPInterpolatedMaterial attribute)
amt (s4.tmr.MaterialWithEnergy attribute)
B
B (s4.thermo.exp.EnthalpyEq attribute)
(s4.thermo.exp.GibbsFormationEq attribute)
C
C (s4.thermo.exp.EnthalpyEq attribute)
(s4.thermo.exp.GibbsFormationEq attribute)
CannotBalance
comment (s4.thermo.exp.EnthalpyEq attribute)
competing_phases() (s4.tmr.MPUniverseInterpolation static method)
composition (s4.tmr.ExpDeterminedMaterial attribute)
(s4.tmr.GasMaterial attribute)
(s4.tmr.MaterialWithEnergy attribute)
(s4.tmr.MPInterpolatedMaterial property)
compositions (s4.tmr.MPInterpolatedMaterial attribute)
compute_cascade() (in module s4.cascade.analysis)
compute_corrected_dgf_mp() (in module s4.thermo.calc)
compute_corrected_dgf_scan() (in module s4.thermo.calc)
compute_corrected_dhf_mp() (in module s4.thermo.calc)
compute_corrected_dhf_scan() (in module s4.thermo.calc)
custom_grid_search() (in module s4.ml.nonlinear)
D
D (s4.thermo.exp.EnthalpyEq attribute)
(s4.thermo.exp.GibbsFormationEq attribute)
density (s4.thermo.exp.FREEDEntry attribute)
desc (s4.thermo.exp.FREEDEntry attribute)
dgcrxn() (s4.tmr.ReactionEnergies method)
dgf() (s4.thermo.exp.ExpThermoDatabase method)
(s4.thermo.exp.FREEDEntry method)
(s4.tmr.ExpDeterminedMaterial method)
(s4.tmr.GasMaterial method)
(s4.tmr.MPInterpolatedMaterial method)
dgf_eqs (s4.thermo.exp.FREEDEntry attribute)
dgrxn() (s4.tmr.ReactionEnergies method)
dh_eqs (s4.thermo.exp.FREEDEntry attribute)
dhf() (s4.thermo.exp.ExpThermoDatabase method)
(s4.tmr.ExpDeterminedMaterial method)
(s4.tmr.GasMaterial method)
(s4.tmr.MPInterpolatedMaterial method)
driving_force (s4.cascade.thermo.ReactionDrivingForce attribute)
E
E (s4.thermo.exp.EnthalpyEq attribute)
(s4.thermo.exp.GibbsFormationEq attribute)
elements (s4.ml.features.Featurizer attribute)
ent0 (s4.thermo.exp.FREEDEntry attribute)
EnthalpyEq (class in s4.thermo.exp)
estimate_average_partial_importance() (in module s4.ml.nonlinear)
exp_t (s4.tmr.ReactionEntry attribute)
exp_time (s4.tmr.ReactionEntry attribute)
ExpDeterminedMaterial (class in s4.tmr)
experimental_dgcrxn() (s4.tmr.ReactionEntry method)
experimental_dgrxn() (s4.tmr.ReactionEntry method)
ExpThermoDatabase (class in s4.thermo.exp)
F
F (s4.thermo.exp.EnthalpyEq attribute)
(s4.thermo.exp.GibbsFormationEq attribute)
feature_importance() (in module s4.ml.wls)
featurize() (s4.ml.features.Featurizer method)
Featurizer (class in s4.ml.features)
find_cascade_reaction() (in module s4.cascade.cascade_model)
find_competing_reactions() (in module s4.cascade.cascade_model)
(in module s4.cascade.greedy_resolver)
finite_dg_correction() (in module s4.thermo.calc)
formula (s4.thermo.exp.FREEDEntry attribute)
forward_selection_by_bic() (in module s4.ml.wls)
FREEDEntry (class in s4.thermo.exp)
from_material_dict() (s4.tmr.ExpDeterminedMaterial static method)
(s4.tmr.MPInterpolatedMaterial static method)
from_reaction_entry() (s4.tmr.ReactionEntry static method)
from_reactions() (in module s4.tmr)
from_reactions_multiprocessing() (in module s4.tmr)
from_row() (s4.thermo.exp.FREEDEntry static method)
fugacity (s4.tmr.GasMaterial attribute)
G
G (s4.thermo.exp.GibbsFormationEq attribute)
gases (s4.cascade.thermo.ReactionDrivingForce attribute)
GasMaterial (class in s4.tmr)
generate_pt_triangulation() (in module s4.ml.plotting)
geometry_energy() (s4.tmr.MPUniverseInterpolation static method)
get_dgf_fu() (in module s4.cascade.thermo)
get_gas_mu() (in module s4.cascade.thermo)
GibbsFormationEq (class in s4.thermo.exp)
H
h() (s4.thermo.exp.ExpThermoDatabase method)
(s4.thermo.exp.FREEDEntry method)
h0 (s4.thermo.exp.FREEDEntry attribute)
H_transition (s4.thermo.exp.EnthalpyEq attribute)
I
interpolate() (s4.tmr.MPUniverseInterpolation method)
InvalidMPIdError
is_target (s4.tmr.MaterialWithEnergy attribute)
K
k (s4.tmr.ReactionEntry attribute)
L
linear_model_analysis() (in module s4.ml.wls)
M
MaterialWithEnergy (class in s4.tmr)
mineral_name (s4.thermo.exp.FREEDEntry attribute)
model_cv_analysis() (in module s4.ml.nonlinear)
module
s4.cascade.analysis
s4.cascade.balance
s4.cascade.cascade_model
s4.cascade.greedy_resolver
s4.cascade.thermo
s4.ml.features
s4.ml.nonlinear
s4.ml.plotting
s4.ml.wls
s4.thermo.calc
s4.thermo.exp
s4.tmr
molar_mass (s4.thermo.exp.FREEDEntry attribute)
mp_data_by_temp (s4.tmr.MPUniverseInterpolation property)
mp_entries (s4.tmr.MPInterpolatedMaterial attribute)
mp_space (s4.tmr.MPUniverseInterpolation property)
MPInterpolatedMaterial (class in s4.tmr)
MPUniverseInterpolation (class in s4.tmr)
mu() (s4.tmr.GasMaterial method)
N
name (s4.thermo.exp.FREEDEntry attribute)
neighbors() (s4.tmr.MPUniverseInterpolation method)
O
optimize_energy() (s4.tmr.MPUniverseInterpolation static method)
P
periodic_table_heatmap() (in module s4.ml.plotting)
periodic_table_heatmap_sbs() (in module s4.ml.plotting)
plot_dgf() (s4.thermo.exp.FREEDEntry method)
plot_h() (s4.thermo.exp.FREEDEntry method)
polytypes (s4.tmr.MPInterpolatedMaterial property)
Q
query_system_mp() (in module s4.thermo.calc)
query_system_scan() (in module s4.thermo.calc)
quick_balance() (in module s4.cascade.balance)
R
reactants (s4.cascade.thermo.ReactionDrivingForce attribute)
reaction_driving_force() (in module s4.cascade.thermo)
reaction_string (s4.cascade.thermo.ReactionDrivingForce attribute)
(s4.tmr.ReactionEnergies property)
(s4.tmr.ReactionEntry attribute)
ReactionDrivingForce (class in s4.cascade.thermo)
ReactionEnergies (class in s4.tmr)
ReactionEntry (class in s4.tmr)
reactions (s4.tmr.ReactionEntry attribute)
reduce_formula() (in module s4.cascade.thermo)
S
s4.cascade.analysis
module
s4.cascade.balance
module
s4.cascade.cascade_model
module
s4.cascade.greedy_resolver
module
s4.cascade.thermo
module
s4.ml.features
module
s4.ml.nonlinear
module
s4.ml.plotting
module
s4.ml.wls
module
s4.thermo.calc
module
s4.thermo.exp
module
s4.tmr
module
scatter_matrix_plot() (in module s4.ml.plotting)
side (s4.tmr.MaterialWithEnergy attribute)
species (s4.tmr.ReactionEnergies attribute)
T
T_transition (s4.thermo.exp.EnthalpyEq attribute)
(s4.thermo.exp.GibbsFormationEq attribute)
target (s4.tmr.ReactionEnergies attribute)
thermo (s4.tmr.MaterialWithEnergy attribute)
thermo_temps (s4.ml.features.Featurizer attribute)
tmax (s4.thermo.exp.FREEDEntry attribute)
V
vars_sub (s4.tmr.ReactionEnergies attribute)